SCHEMBL30054908

SCHEMBL30054908

N#Cc1cc(F)cc2c1CCCC2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.41
▸ ALDH1A1 P00352 7/20 0.41
▸ HPGD P15428 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ APOBEC3G Q9HC16 1/20 0.41
▸ HSD17B10 Q99714 3/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ TRPV4 Q9HBA0 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ HIF1A Q16665 1/20 0.34
▸ CYP11B2 P19099 1/20 0.33
▸ NOTUM Q6P988 1/20 0.32
▸ GLA P06280 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ MAOA P21397 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
SCHEMBL24524553 0.78 KDM4E (0.40) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL23832894 0.76 KDM4E (0.36) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL7792883 0.76 MAOA (0.33) TSHRMAOAMAOB
SCHEMBL29362523 0.76 MAOA (0.33) TSHRMAOAMAOB
SCHEMBL30054919 0.74 KDM4E (0.38) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL23832875 0.74 KDM4E (0.38) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL29915036 0.74 PARP1 (0.41) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL27002417 0.74 PARP1 (0.41) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL24524513 0.73 KDM4E (0.37) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL30047273 0.73 SMN1; SMN2 (0.40) KDM4EALDH1A1HPGDMAPTNPSR1

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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