SCHEMBL597333

SCHEMBL597333

Cc1ccc2c(c1)CCCC2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.49
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
POLB P06746 1/20 0.47
TSHR P16473 1/20 0.46
RAPGEF4 Q8WZA2 1/20 0.46
ALDH1A1 P00352 5/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPT P10636 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
LMNA P02545 1/20 0.44
THRB P10828 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
METAP1 P53582 1/20 0.41
STS P08842 1/20 0.41

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
SCHEMBL22005789 0.97 DPP4 (0.47) DPP4NPC1RAB9APOLBTSHR
SCHEMBL414198 0.95 NPC1 (0.52) DPP4NPC1RAB9APOLBRAPGEF4
Phosphonic Acid SCHEMBL11425732 0.87 NPC1 (0.47) DPP4NPC1RAB9APOLBALDH1A1
Acetic Acid SCHEMBL27990190 0.83 NPC1 (0.56) NPC1RAB9APOLBALDH1A1SMN1; SMN2
SCHEMBL5905931 0.81 CYP11B1 (0.50) DPP4NPC1RAB9APOLBTSHR
SCHEMBL17037968 0.81 METAP1 (0.44) DPP4NPC1RAB9APOLBALDH1A1
SCHEMBL15957848 0.80 PNMT (0.46) ADRA2AADRA2BADRA2C
SCHEMBL6905898 0.79 ALDH1A1 (0.47) NPC1RAB9APOLBALDH1A1SMN1; SMN2
SCHEMBL28692154 0.78 CYP2A6 (0.59) DPP4NPC1RAB9APOLBALDH1A1
SCHEMBL10177007 0.78 METAP1 (0.46) DPP4NPC1RAB9APOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117871743-A Method for simultaneously measuring residual amounts of 8 naphthalene compounds in recovered PET 广州海关技术中心 2024-04-12 CN claimed
US-11637257-B2 Electroluminescent material ink and electroluminescent device thereof GUANGDONG JUHUA PRINTED DISPLAY TECHNOLOGY CO. LTD (CN) 2023-04-25 US claimed
US-20220152587-A1 JUTE STEM-SUPPORTED PALLADIUM-NPS AND USE AS DIP-CATALYSTS FOR AQUEOUS TRANSFER HYDROGENATION KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2022-05-19 US claimed
CN-109929328-B Composite ink and preparation method and device thereof TCL科技集团股份有限公司 2021-10-22 CN claimed
US-20200373508-A1 ELECTROLUMINESCENT MATERIAL INK AND ELECTROLUMINESCENT DEVICE THEREOF GUANGDONG JUHUA PRINTED DISPLAY TECHNOLOGY CO., LTD. (CN) 2020-11-26 US claimed
CN-108948865-B Electroluminescent material ink and electroluminescent device thereof 广东聚华印刷显示技术有限公司 2020-07-10 CN claimed
EP-1220852-B1 SUBSTITUTED DIAZEPANS NOVARTIS AG (CH) 2006-01-18 EP claimed
EP-1220852-A1 SUBSTITUTED DIAZEPANS Novartis AG (CH) 2002-07-10 EP claimed
US-6399599-B1 ANTIINFLAMMATOY AGENTS; AUTOIMMUNE DISEASE NOVARTIS AG (CH) 2002-06-04 US claimed
US-6235753-B1 TUMOR NECROSIS FACTOR; AUTOIMMUNE DISEASES; ANTIALLERGENS SMITHKLINE BEECHAM P.L.C. (GB) 2001-05-22 US claimed
WO-2001027102-A1 SUBSTITUTED DIAZEPANES NOVARTIS AG (CH) 2001-04-19 WO claimed
US-5107062-A Selective adsorption, cation exchanging UOP (US) 1992-04-21 US claimed
EP-0192492-B1 PEPTIDES CONTAINING AN ALIPHATIC-AROMATIC KETONE SIDE CHAIN THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1992-01-02 EP claimed
US-5073654-A Catalyzing in presence of zeolite type beta UOP (US) 1991-12-17 US claimed
JP-6184008-A None JP disclosed
US-12540073-B2 Heterogeneous hydrogen-catalyst solid fuel reaction mixture and reactor BRILLIANT LIGHT POWER, INC. (US) 2026-02-03 US disclosed
US-12414565-B2 Pyridazine (THIO)amides as fungicidal compounds BAYER AKTIENGESELLSCHAFT (DE) 2025-09-16 US disclosed
US-4458047-A HEATING WITH ACID CATALYST SUN TECH, INC. (US) 1984-07-03 US disclosed
US-4224458-A Process for homogeneous hydrogenation of polycyclic aromatic hydrocarbons ALLIED CHEMICAL CORPORATION (US) 1980-09-23 US disclosed
US-4108963-A SOLVENT EXTRACTION PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1978-08-22 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 (2 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-12414565-B2 Pyridazine (THIO)amides as fungicidal compounds PNPO, TPMT, BLVRB DPP4 2100/4885NPC1 2953/4885RAB9A 1625/4885
US-12540073-B2 Heterogeneous hydrogen-catalyst solid fuel reaction mixture and reactor SCO2, SOD1, HAO2 DPP4 4686/4885NPC1 3402/4885RAB9A 1741/4885

“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.