SCHEMBL866880

SCHEMBL866880

CCCCCCC(C(=O)O)C(Cl)Cl

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.55
FFAR1 O14842 2/20 0.55
MAPT P10636 1/20 0.53
LCK P06239 1/20 0.53
PPARD Q03181 1/20 0.53
ZDHHC20 Q5W0Z9 1/20 0.53
ZDHHC2 Q9UIJ5 1/20 0.53
ACE2 Q9BYF1 1/20 0.50
GRIK1 P39086 2/20 0.46
GRIK2 Q13002 2/20 0.46
FFAR4 Q5NUL3 1/20 0.46
SLC1A2 P43004 1/20 0.43
SLC1A1 P43005 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CA2 P00918 1/20 0.42
HSPD1 P10809 1/20 0.42
BLM P54132 1/20 0.42
HSPE1 P61604 1/20 0.42

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
SCHEMBL10581578 1.00 GPR84 (0.55) GPR84FFAR1MAPTLCKPPARD
SCHEMBL26969032 0.87 GPR84 (0.64) GPR84FFAR1MAPTLCKPPARD
SCHEMBL337012 0.87 GPR84 (0.64) GPR84FFAR1MAPTLCKPPARD
SCHEMBL26969034 0.87 GPR84 (0.64) GPR84FFAR1MAPTLCKPPARD
SCHEMBL337767 0.87 GPR84 (0.64) GPR84FFAR1MAPTLCKPPARD
SCHEMBL338186 0.87 GPR84 (0.64) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9066915 0.87 GPR84 (0.64) GPR84FFAR1MAPTLCKPPARD
SCHEMBL5547897 0.87 GPR84 (0.64) GPR84FFAR1MAPTLCKPPARD
SCHEMBL37192 0.87 GPR84 (0.64) GPR84FFAR1MAPTLCKPPARD
SCHEMBL26969033 0.87 GPR84 (0.64) GPR84FFAR1MAPTLCKPPARD

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160023978-A1 6-HYDROXY-2-NAPHTHALENYL FLUORENE DERIVATIVES AND LENS AND CAMERA MODULE USING THE SAME SAMSUNG ELECTRO-MECHANICS CO., LTD. (KR) 2016-01-28 US disclosed
EP-2675479-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES Immunogen, Inc. (US) 2013-12-25 EP disclosed
EP-2675481-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES AND METHODS OF PREPARATION ImmunoGen, Inc. (US) 2013-12-25 EP disclosed
US-8609839-B2 Camphor-derived compounds, method for manufacturing the same, and application thereof NATIONAL TSING HUA UNIVERSITY (TW) 2013-12-17 US disclosed
WO-2012128868-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. (US) 2012-09-27 WO disclosed
WO-2012112708-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES AND METHODS OF PREPARATION IMMUNOGEN, INC. (US) 2012-08-23 WO disclosed
US-20120077976-A1 CAMPHOR-DERIVED COMPOUNDS, METHOD FOR MANUFACTURING THE SAME, AND APPLICATION THEREOF NATIONAL TSING HUA UNIVERSITY (TW) 2012-03-29 US disclosed
US-20100120803-A1 3,4-DIHYDROQUINAZOLINE DERIVATIVES DONGWOO SYNTECH CO., LTD. (KR) 2010-05-13 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 (3 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-20120077976-A1 CAMPHOR-DERIVED COMPOUNDS, METHOD FOR MANUFACTURING THE SAME, AND APPLICATION THEREOF PDE10A, PDE6H, PRKAR2A GPR84 805/4885FFAR1 633/4885MAPT 3724/4885
US-20160023978-A1 6-HYDROXY-2-NAPHTHALENYL FLUORENE DERIVATIVES AND LENS AND CAMERA MODULE USING THE SAME SUN2, UACA, HNF4A GPR84 2788/4885FFAR1 367/4885MAPT 1162/4885
US-20100120803-A1 3,4-DIHYDROQUINAZOLINE DERIVATIVES CACNA1I, CACNA1G, CACNA1H GPR84 1251/4885FFAR1 3306/4885MAPT 2035/4885

“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.