SCHEMBL3228565

SCHEMBL3228565

Cc1sc(Br)c(C(=O)O)c1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.47
RECQL P46063 1/20 0.47
GPR35 Q9HC97 3/20 0.42
ABCC1 P33527 3/20 0.40
MAPT P10636 7/20 0.39
ALDH1A1 P00352 5/20 0.39
LMNA P02545 2/20 0.39
GRIN2C Q14957 1/20 0.38
ALOX12 P18054 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.36
PLA2G1B P04054 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
DAO P14920 1/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34

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
SCHEMBL5727379 0.82 GPR35 (0.42) POLBRECQLGPR35ABCC1MAPT
SCHEMBL8304526 0.78 POLB (0.52) POLBRECQLGPR35ABCC1MAPT
SCHEMBL3130253 0.77 GPR35 (0.43) POLBRECQLGPR35ALDH1A1LMNA
SCHEMBL9278011 0.77 KDM4E (0.48) MAPTALDH1A1L3MBTL1HPGDKDM4E
SCHEMBL3116158 0.75 ALDH1A1 (0.44) POLBRECQLGPR35MAPTALDH1A1
SCHEMBL1498222 0.75 GSK3B (0.44) GPR35ALDH1A1KMT2ADAO
SCHEMBL8104317 0.74 MAPK1 (0.55) MAPTALDH1A1LMNAHPGDMAPK1
SCHEMBL3497284 0.73 ALDH1A1 (0.61) POLBRECQLABCC1MAPTALDH1A1
SCHEMBL9886887 0.72 ALDH1A1 (0.52) POLBMAPTALDH1A1LMNAALOX12
SCHEMBL16213064 0.72 EED (0.47) POLBRECQLGPR35ABCC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010009847-A1 HETEROCYCLICALLY SUBSTITUTED AMIDES, METHOD FOR THE PRODUCTION THEREOF, AND USE AS HERBICIDES BAYER CROPSCIENCE AG (DE) 2010-01-28 WO disclosed
EP-2147919-A1 Heterocyclic substituted amides, method for their manufacture and their use as herbicides Bayer CropScience Aktiengesellschaft (DE) 2010-01-27 EP disclosed
EP-1016664-B1 FUSED THIOPHENE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2003-07-02 EP disclosed
US-6455521-B1 PSYCHOLOGICAL DISORDERS; SIDE EFFECT REDUCTION MITSUBISHI PHARMA CORPORATION (JP) 2002-09-24 US disclosed
US-20020042411-A1 Condensed thiophene compounds and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2002-04-11 US disclosed
US-6271225-B1 PSYCHOLOGICAL DISORDERS WELFIDE CORPORATION (JP) 2001-08-07 US disclosed
CN-1268949-A Fused thiophene compounds and medical use thereof YOSHITOMI PHARMACEUTICAL (JP) 2000-10-04 CN disclosed
EP-1016664-A1 FUSED THIOPHENE COMPOUNDS AND MEDICINAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2000-07-05 EP disclosed
EP-0797578-B1 FUNGICIDES FOR THE CONTROL OF TAKE-ALL DISEASE OF PLANTS MONSANTO CO (US) 2000-05-10 EP disclosed
CN-1052234-C Fungicides for the control of take-all disease of plants MONSANTO CO (US) 2000-05-10 CN disclosed
CN-1176642-A Fungicide for preventing and treating take-all disease of plant MONSANTO CO (US) 1998-03-18 CN disclosed
EP-0797578-A1 FUNGICIDES FOR THE CONTROL OF TAKE-ALL DISEASE OF PLANTS MONSANTO COMPANY (US) 1997-10-01 EP disclosed
WO-1996018631-A1 FUNGICIDES FOR THE CONTROL OF TAKE-ALL DISEASE OF PLANTS MONSANTO COMPANY (US) 1996-06-20 WO disclosed
US-5486621-A 4,5-DOMETHYL-N-2-PROPENYL-2-(TRIMETHYLSILYL)-3-THIOPHENE CARBOXAMIDE MONSANTO COMPANY (US) 1996-01-23 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 (1 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-20020042411-A1 Condensed thiophene compounds and pharmaceutical use thereof ACIN1, ACHE, TPMT POLB 1763/4885RECQL 1637/4885GPR35 3126/4885

“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.