SCHEMBL162882

SCHEMBL162882

CC(C)c1cc2ccccc2o1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.52
MGAM O43451 1/20 0.52
GAA P10253 1/20 0.52
SI P14410 1/20 0.52
PTPN1 P18031 1/20 0.52
ACHE P22303 1/20 0.52
RAB9A P51151 1/20 0.52
MGAM2 Q2M2H8 1/20 0.52
CYP2D6 P10635 1/20 0.51
HIF1A Q16665 1/20 0.51
POLB P06746 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KDM4E B2RXH2 3/20 0.45
CYP2A6 P11509 2/20 0.45
FLT3 P36888 1/20 0.45
LOXL2 Q9Y4K0 1/20 0.45
MGLL Q99685 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
MAOB P27338 4/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28045336 0.87 CYP2D6 (0.49) NPC1MGAMGAASIPTPN1
SCHEMBL17785118 0.83 CYP2D6 (0.49) CYP2D6HIF1APOLBSMN1; SMN2KDM4E
SCHEMBL21865143 0.83 CYP2D6 (0.49) NPC1RAB9ACYP2D6HIF1APOLB
SCHEMBL4047365 0.83 CYP2D6 (0.57) NPC1GAARAB9ACYP2D6HIF1A
SCHEMBL12087087 0.83 ALDH1A1 (0.49) NPC1RAB9ACYP2D6HIF1APOLB
SCHEMBL12569555 0.83 CYP2D6 (0.49) CYP2D6HIF1APOLBSMN1; SMN2KDM4E
SCHEMBL17969087 0.83 CYP2D6 (0.49) RAB9ACYP2D6HIF1APOLBSMN1; SMN2
SCHEMBL21003972 0.83 CYP2D6 (0.49) CYP2D6HIF1APOLBSMN1; SMN2KDM4E
SCHEMBL1707058 0.83 CYP2D6 (0.49) CYP2D6HIF1APOLBSMN1; SMN2KDM4E
SCHEMBL12626506 0.83 CYP2D6 (0.49) NPC1RAB9ACYP2D6HIF1APOLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 617 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113122061-A Quantum dot ink and preparation method of quantum dot film TCL集团股份有限公司 2021-07-16 CN claimed
US-4230624-A CYCLIZATION, BASIC CATALYSTS AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (FR) 1980-10-28 US claimed
US-20240239811-A1 5-(5-(PIPERIDIN-4-YL)THIENO[3,2-C]PYRAZOL-2-YL]INDAZOLE DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS FOR SPLICING NUCLEIC ACIDS AND FOR THE T REMIX THERAPEUTICS INC. 2024-07-18 US disclosed
US-12030878-B2 Substituted indole ether compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-09 US disclosed
US-12024507-B2 Compounds as GLP-1R agonists TERNS PHARMACEUTICALS, INC. (US) 2024-07-02 US disclosed
US-12018045-B2 17-beta-hydroxywithanolides and use thereof in treating cancer THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2024-06-25 US disclosed
US-12018045-B2 17-beta-hydroxywithanolides and use thereof in treating cancer THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2024-06-25 US disclosed
US-20240199604-A1 SUPRAMOLECULAR POLYMER THERAPEUTICS AND DIAGNOSTICS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-06-20 US disclosed
US-20240199604-A1 SUPRAMOLECULAR POLYMER THERAPEUTICS AND DIAGNOSTICS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-06-20 US disclosed
WO-2024059107-A1 IKZF2 AND CK1-ALPHA DEGRADING COMPOUNDS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2024-03-21 WO disclosed
US-20240072809-A1 ASGPR-BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS AVILAR THERAPEUTICS, INC. (US) 2024-02-29 US disclosed
US-7176312-B2 Kinase inhibitor scaffolds and methods for their preparation THE SCRIPPS RESEARCH INSTITUTE (US) 2007-02-13 US disclosed
US-20050148775-A1 Process for production of heteroaryl-type boron compounds with iridium catalyst MITSUBISHI RAYON CO., LTD. (JP) 2005-07-07 US disclosed
EP-1481978-A1 PROCESS FOR PRODUCTION OF HETEROARYL-TYPE BORON COMPOUNDS WITH IRIDIUM CATALYST Mitsubishi Rayon Co., Ltd. (JP) 2004-12-01 EP disclosed
WO-2004058679-A2 LIGANDS OF ADENINE NUCLEOTIDE TRANSLOCASE (ANT) AND COMPOSITIONS AND METHODS RELATED THERETO MIGENIX CORP. (US) 2004-07-15 WO disclosed
US-20040102472-A1 Method of preparing inhibitors of phosphodiesterase-4 MERCK & CO., INC. 2004-05-27 US disclosed
EP-0056271-B1 CARBOXYLIC ACID ESTERS AND INSECTICIDAL AND/OR ACARICIDAL COMPOSITIONS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-05-07 EP disclosed
US-4480118-A Carboxylic acid ester and an insecticidal and/or acaricidal composition containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-10-30 US disclosed
EP-0056271-A2 Carboxylic acid esters and insecticidal and/or acaricidal compositions SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-07-21 EP disclosed
US-4230624-A CYCLIZATION, BASIC CATALYSTS AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (FR) 1980-10-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240199604-A1 SUPRAMOLECULAR POLYMER THERAPEUTICS AND DIAGNOSTICS MAPT, HTT, PSEN1 NPC1 256/4885MGAM 1171/4885GAA 80/4885
US-20040102472-A1 Method of preparing inhibitors of phosphodiesterase-4 PDE4B, PDE4A, PDE5A NPC1 3077/4885MGAM 1825/4885GAA 500/4885
US-12024507-B2 Compounds as GLP-1R agonists GLP1R, GIPR, GCGR NPC1 527/4885MGAM 1609/4885GAA 586/4885
US-20050148775-A1 Process for production of heteroaryl-type boron compounds with iridium catalyst PIN4, IPO5, HLCS NPC1 876/4885MGAM 2304/4885GAA 1955/4885
US-12018045-B2 17-beta-hydroxywithanolides and use thereof in treating cancer HSD17B7, CYP17A1, HSD17B11 NPC1 1857/4885MGAM 4464/4885GAA 2894/4885
US-12030878-B2 Substituted indole ether compounds TLR7, TLR8, TLR1 NPC1 3064/4885MGAM 4079/4885GAA 3138/4885
US-20240239811-A1 5-(5-(PIPERIDIN-4-YL)THIENO[3,2-C]PYRAZOL-2-YL]INDAZOLE DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS FOR SPLICING NUCLEIC ACIDS AND FOR THE T HNRNPAB, HNRNPC, HNRNPA1 NPC1 459/4885MGAM 4792/4885GAA 23/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.