SCHEMBL982940

SCHEMBL982940

COc1ccc(C[S])cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.58
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA7 P43166 1/20 0.58
CA9 Q16790 1/20 0.58
CA14 Q9ULX7 1/20 0.58
AGXT P21549 2/20 0.54
LTA4H P09960 1/20 0.54
TAAR1 Q96RJ0 1/20 0.54
ALDH1A1 P00352 3/20 0.52
ALOX15 P16050 2/20 0.52
TP53 P04637 1/20 0.52
CYP3A4 P08684 1/20 0.52
TSHR P16473 1/20 0.52
ALOX12 P18054 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
PKM P14618 1/20 0.52
MIF P14174 1/20 0.52
SLC6A4 P31645 1/20 0.50

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
SCHEMBL5609660 0.80 TAAR1 (0.61) IDO1CA12CA1CA2CA7
SCHEMBL979649 0.79 IDO1 (0.58) IDO1CA12CA1CA2CA7
SCHEMBL130044 0.79 IDO1 (0.58) IDO1CA12CA1CA2CA7
SCHEMBL1425001 0.78 LTA4H (0.81) IDO1CA12CA1CA2CA7
SCHEMBL834551 0.78 TAAR1 (0.73) IDO1CA12CA1CA2CA7
SCHEMBL25986524 0.78 LTA4H (0.81) IDO1CA12CA1CA2CA7
SCHEMBL27884 0.78 LTA4H (0.81) IDO1CA12CA1CA2CA7
SCHEMBL5610091 0.77 CALM1 (0.62) IDO1TAAR1ALDH1A1ALOX15CALM1
SCHEMBL3937672 0.77 IDO1 (0.57) IDO1CA12CA1CA2CA7
1,4-Dimethoxybenzene SCHEMBL21802643 0.76 CA1 (1.00) IDO1CA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111434660-B 4-pyridyl formamide compound or derivative thereof, preparation method, herbicidal composition and application 青岛清原化合物有限公司 2021-10-08 CN claimed
WO-2020147705-A1 4-PYRIDINYL FORMAMIDE COMPOUND OR DERIVATIVE THEREOF, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF 青岛清原化合物有限公司 2020-07-23 WO claimed
CN-111434660-A 4-pyridyl formamide compound or derivative thereof, preparation method, herbicidal composition and application 青岛清原化合物有限公司 2020-07-21 CN claimed
EP-1478653-B1 MACROLIDES WITH ANTIBACTERIAL ACTIVITY BASILEA PHARMACEUTICA AG (CH) 2014-07-02 EP claimed
JP-4603265-B2 2010-12-22 JP claimed
EP-1326993-B1 PRODUCTION OF ALPHA-HYDROXY-CARBOXYLIC ACIDS USING A COUPLED ENZYME SYSTEM EXCELSYN MOLECULAR DEV LTD (GB) 2007-05-23 EP claimed
EP-1699799-B1 CONTROL OF PARASITES IN ANIMALS BY THE USE OF IMIDAZO [1,2-B]PYRIDAZINE DERIVATIVES SCHERING PLOUGH LTD (CH) 2007-05-16 EP claimed
US-6995143-B2 Macrolides with antibacterial activity BASILEA PHARMACEUTICA AG (CH) 2006-02-07 US claimed
EP-1478653-A1 MACROLIDES WITH ANTIBACTERIAL ACTIVITY Basilea Pharmaceutica AG (CH) 2004-11-24 EP claimed
US-20040053382-A1 Production of alpha-hydroxy-carboxylic acids using a coupled enzyme system EXCELSYN MOLECULAR DEVELOPMENT LIMITED (GB) 2004-03-18 US claimed
WO-2003072588-A1 MACROLIDES WITH ANTIBACTERIAL ACTIVITY BASILEA PHARMACEUTICA AG (CH) 2003-09-04 WO claimed
US-6518266-B1 1- Aryl-3-thioalkyl pyrazoles, the synthesis thereof and the use thereof as insecticides 3-DIMENSIONAL PHARMACEUTICALS 2003-02-11 US claimed
WO-2001007413-A1 1-ARYL-3-THIOALKYL PYRAZOLES, THE SYNTHESIS THEREOF AND THE USE THEREOF AS INSECTICIDES 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2001-02-01 WO claimed
EP-0447171-B1 Polysulfate of cyclodextrin derivative and process for preparing the same TANABE SEIYAKU CO (JP) 1994-11-02 EP claimed
US-5250520-A Antiretrovirus activity TANABE SEIYAKU CO., LTD. (JP) 1993-10-05 US claimed
EP-0289371-B1 IMIDAZOPYRIDINE DERIVATIVES, THEIR PREPARATION AND THERAPEUTICAL USE SYNTHELABO (FR) 1991-09-25 EP claimed
EP-0447171-A2 Polysulfate of cyclodextrin derivative and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1991-09-18 EP claimed
US-4847263-A SEDATIVES, ANXIOLITIC AGENTS SYNTHELABO (FR) 1989-07-11 US claimed
US-4731370-A VASODILATOR, ANTICOAGULANT TOYAMA CHEMICAL CO., LTD. (JP) 1988-03-15 US claimed
US-4713387-A Vasodilating and platelet aggregation inhibiting 1,4 dihydropyridines with an imidazolyl or pyridyl containing ester TOYAMA CHEMICAL CO., LTD. (JP) 1987-12-15 US claimed