SCHEMBL30053773

SCHEMBL30053773

N#Cc1cc(F)cc2c1CCCC2=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.40
▸ KDM4E B2RXH2 4/20 0.37
▸ NPSR1 Q6W5P4 3/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ CYP11B2 P19099 1/20 0.35
▸ NOTUM Q6P988 1/20 0.35
▸ PGR P06401 1/20 0.34
▸ MAOA P21397 5/20 0.33
▸ MAOB P27338 5/20 0.33
▸ PRKCI P41743 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CYP2A6 P11509 1/20 0.32
▸ ABCC9 O60706 1/20 0.32

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
SCHEMBL16569461 0.89 NOTUM (0.36) GRM5KDM4ENPSR1ALDH1A1TSHR
SCHEMBL30070487 0.79 MAOA (0.44) KDM4ENPSR1MAOAMAOBPRKCI
SCHEMBL8459403 0.79 MAOA (0.44) KDM4ENPSR1MAOAMAOBPRKCI
SCHEMBL11460490 0.78 BRD4 (0.38) KDM4ENPSR1ALDH1A1TSHRMAPT
SCHEMBL24543321 0.76 NOTUM (0.42) KDM4ENPSR1ALDH1A1L3MBTL1MAPT
SCHEMBL29673151 0.76 NOTUM (0.42) KDM4ENPSR1ALDH1A1L3MBTL1MAPT
SCHEMBL30083746 0.76 ALDH1A1 (0.36) GRM5KDM4ENPSR1ALDH1A1MAPT
SCHEMBL28937922 0.76 ALDH1A1 (0.36) GRM5KDM4ENPSR1ALDH1A1MAPT
SCHEMBL23832875 0.76 KDM4E (0.38) GRM5KDM4ENPSR1ALDH1A1MAPT
SCHEMBL30054919 0.76 KDM4E (0.38) GRM5KDM4ENPSR1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119118872-A Tetrahydronaphthalene and tetrahydroquinoline compounds as HIF-2 alpha inhibitors 艾库斯生物科学有限公司 2024-12-13 — — CN disclosed
CN-115298165-B Tetrahydronaphthalene and tetrahydroquinoline compounds as HIF-2 alpha inhibitors 艾库斯生物科学有限公司 2024-09-17 — — CN disclosed
EP-4121409-A1 TETRALIN AND TETRAHYDROQUINOLINE COMPOUNDS AS INHIBITORS OF HIF-2ALPHA Arcus Biosciences, Inc. (US) 2023-01-25 — — EP disclosed
CN-115298165-A Tetralin and tetrahydroquinoline compounds as HIF-2 alpha inhibitors 艾库斯生物科学有限公司 2022-11-04 — — CN disclosed
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