SCHEMBL453234

SCHEMBL453234

Fc1ccc(Oc2cc[c]cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.47
HSPB1 P04792 1/20 0.47
SCN4A P35499 3/20 0.41
GAA P10253 1/20 0.39
LTA4H P09960 2/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
KDM4E B2RXH2 2/20 0.38
EPHX2 P34913 1/20 0.37
FFAR1 O14842 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37
ALDH1A1 P00352 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
HTT P42858 1/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36

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
SCHEMBL609237 0.84 LTA4H (0.44) GAALTA4HMEN1KMT2AALDH1A1
SCHEMBL6290683 0.84 SOS1 (0.58) SOS1HSPB1SCN4AGAALTA4H
SCHEMBL6289867 0.84 SOS1 (0.58) SOS1HSPB1SCN4AGAALTA4H
SCHEMBL351854 0.84 SOS1 (0.58) SOS1HSPB1SCN4AGAALTA4H
SCHEMBL921111 0.81 VEGFA (0.37) SOS1HSPB1LTA4HFFAR1FFAR4
SCHEMBL29375733 0.81 SOS1 (0.56) SOS1HSPB1SCN4AGAALTA4H
SCHEMBL7367702 0.81 SOS1 (0.56) SOS1HSPB1SCN4AGAALTA4H
SCHEMBL10839908 0.79 ALDH1A1 (0.39) SCN4ALTA4HMEN1KMT2AALDH1A1
SCHEMBL29170634 0.78 SOS1 (0.54) SOS1HSPB1SCN4AGAALTA4H
SCHEMBL28256971 0.78 CA1 (0.42) MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022012550-A1 SUBSTITUTED 1H-IMIDAZO [1, 2-B] PYRAZOLE-3-CARBOXAMIDE AS BRUTON'S TYROSINE KINASE INHIBITORS HENAN NORMAL UNIVERSITY (CN) 2022-01-20 WO claimed
EP-3526212-B1 SUBSTITUTED 6-(1H-PYRAZOL-1-YL)PYRIMIDIN-4-AMINE DERIVATIVES AND USES THEREOF BAYER AG (DE) 2021-12-22 EP claimed
WO-2021110142-A1 SUBSTITUTED IMIDAZOLECARBOXAMIDE AS BRUTON'S TYROSINE KINASE INHIBITORS HENAN NORMAL UNIVERSITY (CN) 2021-06-10 WO claimed
EP-3414237-B1 SUBSTITUTED 2-OXYIMIDAZOLYL-CARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2020-12-23 EP claimed
EP-3475286-A1 SUBSTITUTED PYRROLO [2, 3-D]PYRIDAZIN-4-ONES AND PYRAZOLO [3, 4-D]PYRIDAZIN-4-ONES AS PROTEIN KINASE INHIBITORS Shanghai Fochon Pharmaceutical Co., Ltd. (CN) 2019-05-01 EP claimed
EP-3414237-A1 SUBSTITUTED 2-OXYIMIDAZOLYL-CARBOXAMIDES AS PEST CONTROL AGENTS Bayer CropScience Aktiengesellschaft (DE) 2018-12-19 EP claimed
WO-2017219955-A1 SUBSTITUTED PYRROLO [2, 3-D] PYRIDAZIN-4-ONES AND PYRAZOLO [3, 4-D] PYRIDAZIN-4-ONES AS PROTEIN KINASE INHIBITORS SHANGHAI FOCHON PHARMACEUTICAL CO., LTD. (CN) 2017-12-28 WO claimed
WO-2017137339-A1 SUBSTITUTED 2-OXYIMIDAZOLYL-CARBOXAMIDES AS PEST CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-08-17 WO claimed
EP-2389066-B1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LTD (GB) 2017-07-05 EP claimed
EP-2387569-B1 HERBCIDES SYNGENTA LTD (GB) 2016-06-15 EP claimed
EP-1068180-A1 PROCESS FOR ALKYLATING HINDERED SULFONAMIDES USEFUL IN THE PRODUCTION OF MATRIX METALLOPROTENASE INHIBITORS Pfizer Products Inc. (US) 2001-01-17 EP claimed
US-6114568-A Process for alkylating hindered sulfonamides useful in the production of matrix metalloproteinase inhibitors PFIZER INC. (US) 2000-09-05 US claimed
CN-1234396-A Process for alkylating hindered sulfonamides PFIZER PRODUCTS CO (US) 1999-11-10 CN claimed
WO-1999052862-A1 PROCESS FOR ALKYLATING HINDERED SULFONAMIDES USEFUL IN THE PRODUCTION OF MATRIX METALLOPROTEINASE INHIBITORS PFIZER PRODUCTS INC. (US) 1999-10-21 WO claimed
EP-0949245-A1 Process for alkylating hindered sulfonamides Pfizer Products Inc. (US) 1999-10-13 EP claimed
US-5932595-A ANTIARTHRITIC AGENT; MULTIPLE SCLEROSIS; OSTEOPOROSIS; RESPIRATORY SYSTEM DISORDERS; SKIN DISORDERS; ANTIULCER AGENT SYNTEX (U.S.A.) INC. (US) 1999-08-03 US claimed
CN-1160045-A Matrix metalloprotease inhibitors HOFFMANN LA ROCHE (CH) 1997-09-24 CN claimed
EP-0780386-A1 Matrix metalloprotease inhibitors F. HOFFMANN-LA ROCHE AG (CH) 1997-06-25 EP claimed
EP-0413666-B1 Butyric acid derivatives CIBA GEIGY AG (CH) 1994-04-13 EP claimed
CN-1019109-B The insect-killing composition that contains diphenyl ether derivatives pesticide compound ICI PLC (GB) 1992-11-18 CN claimed