SCHEMBL204295

SCHEMBL204295

CSCCCOc1cc(C)c(Br)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
LMNA P02545 3/20 0.41
KMT2A Q03164 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
HPGD P15428 1/20 0.39
TSHR P16473 3/20 0.38
MAPT P10636 3/20 0.36
STAT3 P40763 1/20 0.36
NOD2 Q9HC29 1/20 0.36
MCL1 Q07820 1/20 0.34
TP53 P04637 3/20 0.33
MAPK1 P28482 3/20 0.33
PDIA6 Q15084 1/20 0.33
CYP1A2 P05177 1/20 0.33
POLB P06746 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL21168636 0.85 KMT2A (0.41) ALDH1A1KMT2ASMN1; SMN2MEN1NPC1
SCHEMBL16523504 0.81 ALDH1A1 (0.39) ALDH1A1LMNAKMT2ASMN1; SMN2MEN1
SCHEMBL16523503 0.80 ALDH1A1 (0.41) ALDH1A1LMNAKMT2ASMN1; SMN2MEN1
SCHEMBL16523502 0.79 ALDH1A1 (0.45) ALDH1A1LMNAKMT2ASMN1; SMN2HPGD
SCHEMBL6508886 0.79 ALDH1A1 (0.45) ALDH1A1LMNAHPGDTSHRCYP1A2
SCHEMBL3936080 0.78 RAB9A (0.62) ALDH1A1LMNAKMT2ASMN1; SMN2MEN1
SCHEMBL13638790 0.77 NPC1 (0.47) ALDH1A1LMNAKMT2ASMN1; SMN2MEN1
SCHEMBL205849 0.77 MEN1 (0.40) ALDH1A1KMT2ASMN1; SMN2MEN1NPC1
SCHEMBL78064 0.77 ALDH1A1 (0.47) ALDH1A1LMNAHPGDTSHRMAPT
SCHEMBL16515501 0.77 ALDH1A1 (0.44) ALDH1A1LMNAKMT2AMEN1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160200734-A1 CARBOXYLIC ACID COMPOUNDS IN TREATMENT OF DIABETES MELLITUS KANG, XINSHAN (CN) 2016-07-14 US disclosed
US-20160200734-A1 CARBOXYLIC ACID COMPOUNDS IN TREATMENT OF DIABETES MELLITUS KANG, XINSHAN (CN) 2016-07-14 US disclosed
US-20160200734-A1 CARBOXYLIC ACID COMPOUNDS IN TREATMENT OF DIABETES MELLITUS KANG, XINSHAN (CN) 2016-07-14 US disclosed
EP-3036237-A1 CARBOXYLIC ACID COMPOUNDS IN TREATMENT OF DIABETES MELLITUS Fujian Haixi Pharmaceuticals Co. Ltd (CN) 2016-06-29 EP disclosed
WO-2015024526-A1 CARBOXYLIC ACID COMPOUNDS IN TREATMENT OF DIABETES MELLITUS FUJIAN HAIXI PHARMACEUTICALS CO., LTD (CN) 2015-02-26 WO disclosed
WO-2015024526-A1 CARBOXYLIC ACID COMPOUNDS IN TREATMENT OF DIABETES MELLITUS FUJIAN HAIXI PHARMACEUTICALS CO., LTD (CN) 2015-02-26 WO disclosed
EP-2743268-A2 Fused cyclic compounds as GPR40 receptor modulators Takeda Pharmaceutical Company Limited (JP) 2014-06-18 EP disclosed
US-20140080891-A1 FUSED CYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-03-20 US disclosed
US-20140080891-A1 FUSED CYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-03-20 US disclosed
US-20140080891-A1 FUSED CYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-03-20 US disclosed
EP-2248812-A2 Fused cyclic compounds as GPR40 receptor modulators Takeda Pharmaceutical Company Limited (JP) 2010-11-10 EP disclosed
US-20100197761-A1 Fused cyclic compounds YASUMA TSUNEO 2010-08-05 US disclosed
US-20100197761-A1 Fused cyclic compounds YASUMA TSUNEO 2010-08-05 US disclosed
US-20100197761-A1 Fused cyclic compounds YASUMA TSUNEO 2010-08-05 US disclosed
US-7732626-B2 Fused cyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-06-08 US disclosed
US-7732626-B2 Fused cyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-06-08 US disclosed
US-7732626-B2 Fused cyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-06-08 US disclosed
US-20100004312-A1 FUSED CYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-07 US disclosed
US-20100004312-A1 FUSED CYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-07 US disclosed
US-20100004312-A1 FUSED CYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-07 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 (4 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-20160200734-A1 CARBOXYLIC ACID COMPOUNDS IN TREATMENT OF DIABETES MELLITUS GPR119, GLP1R, INSR ALDH1A1 459/4885LMNA 3627/4885KMT2A 4186/4885
US-20140080891-A1 FUSED CYCLIC COMPOUNDS GPR119, GLP1R, GPR65 ALDH1A1 3122/4885LMNA 4399/4885KMT2A 3963/4885
US-20100004312-A1 FUSED CYCLIC COMPOUNDS GPR119, GLP1R, GPR65 ALDH1A1 3122/4885LMNA 4399/4885KMT2A 3963/4885
US-20100197761-A1 Fused cyclic compounds GPR119, GLP1R, GPR65 ALDH1A1 3122/4885LMNA 4399/4885KMT2A 3963/4885

“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.