SCHEMBL3170

SCHEMBL3170

CC1(C(=O)O)CCCCC1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.37
KRAS P01116 1/20 0.36
POLB P06746 1/20 0.34
ALDH1A1 P00352 2/20 0.34
AKR1C1 Q04828 1/20 0.32
GRIN1 Q05586 3/20 0.31
GRIN2A Q12879 3/20 0.31
SLC6A4 P31645 2/20 0.31
GRIN2D O15399 2/20 0.31
GRIN3B O60391 2/20 0.31
GRIN2B Q13224 2/20 0.31
GRIN2C Q14957 2/20 0.31
GRIN3A Q8TCU5 2/20 0.31
OPRK1 P41145 1/20 0.31
LMNA P02545 1/20 0.31
OPRM1 P35372 1/20 0.31
CACNA1C Q13936 1/20 0.31
HTT P42858 1/20 0.31
GAA P10253 1/20 0.31
CYP2C19 P33261 1/20 0.30

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
SCHEMBL8078206 0.98 FFAR3 (0.36) FFAR3KRASPOLBALDH1A1AKR1C1
SCHEMBL1399847 0.93 KRAS (0.41) FFAR3KRASPOLBCYP1A2
SCHEMBL20581854 0.93 KRAS (0.41) FFAR3KRASPOLBCYP1A2
SCHEMBL7763991 0.85 GRIN1 (0.33) POLBALDH1A1GRIN1GRIN2ASLC6A4
SCHEMBL3121522 0.83 POLB (0.37) POLBALDH1A1GRIN1GRIN2ASLC6A4
SCHEMBL7550154 0.78 NPSR1 (0.41) GRIN1GRIN2AGRIN2BCYP2C19
SCHEMBL16407725 0.78 POLB (0.32) POLB
SCHEMBL28218027 0.78 NPSR1 (0.41) GRIN1GRIN2AGRIN2BCYP2C19
SCHEMBL19388527 0.78 GRIN2D (0.34) POLBGRIN1GRIN2AGRIN2DGRIN3B
SCHEMBL16391146 0.78 CYP19A1 (0.33) POLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230400766-A1 ONIUM SALT, RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-12-14 US disclosed
US-10881700-B1 Compositions including extracts of gray mangrove leaves and methods of treatment using such compositions in treatment of viral infections KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2021-01-05 US disclosed
EP-3426391-A1 COMPOSITIONS AND METHODS FOR ACYLATING LACTAMS California Institute of Technology (US) 2019-01-16 EP disclosed
CN-104940202-B Inhibitors of influenza viruses replication 沃泰克斯药物股份有限公司 2018-10-16 CN disclosed
EP-3019196-B1 COMBINATIONS OF HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-06-06 EP disclosed
US-9770439-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-09-26 US disclosed
US-9770439-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-09-26 US disclosed
US-9770439-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-09-26 US disclosed
WO-2017156239-A1 COMPOSITIONS AND METHODS FOR ACYLATING LACTAMS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2017-09-14 WO disclosed
US-20160158200-A1 Combinations of Hepatitis C Virus Inhibitors BRISTOL MYERS SQUIBB CO (US) 2016-06-09 US disclosed
EP-2651940-A1 INHIBITORS OF INFLUENZA VIRUSES REPLICATION Vertex Pharmaceuticals Incorporated (US) 2013-10-23 EP disclosed
EP-2651941-A1 INHIBITORS OF INFLUENZA VIRUSES REPLICATION Vertex Pharmaceuticals Incorporated (US) 2013-10-23 EP disclosed
EP-2485737-A1 NOVEL TRPA1 ANTAGONISTS Merck Sharp & Dohme Corp. (US) 2012-08-15 EP disclosed
US-20120196894-A1 NOVEL TRPA1 ANTAGONISTS SCHERING CORPORATION 2012-08-02 US disclosed
WO-2012083117-A1 INHIBITORS OF INFLUENZA VIRUSES REPLICATION VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-06-21 WO disclosed
WO-2012083121-A1 INHIBITORS OF INFLUENZA VIRUSES REPLICATION VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-06-21 WO disclosed
EP-2448942-A1 FUSED TRICYCLIC COMPOUNDS AS NOVEL mTOR INHIBITORS Schering Corporation (US) 2012-05-09 EP disclosed
WO-2011043954-A1 NOVEL TRPA1 ANTAGONISTS MERCK SHARP & DOHME CORP. (US) 2011-04-14 WO disclosed
CN-101827842-A Oxadiazole derivatives as dgat inhibitors ASTRAZENECA AB 2010-09-08 CN disclosed
US-4959293-A Deep UV photoresist with alkyl 2-diazo-1-ones as solubility modification agents J. T. BAKER, INC. (US) 1990-09-25 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-20160158200-A1 Combinations of Hepatitis C Virus Inhibitors HAVCR2, EIF2AK2, MAVS FFAR3 4255/4885KRAS 819/4885POLB 1787/4885
US-20120196894-A1 NOVEL TRPA1 ANTAGONISTS TRPA1, TRPV1, TRPV2 FFAR3 339/4885KRAS 2142/4885POLB 4859/4885

“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.