SCHEMBL10467547

SCHEMBL10467547

COC(=O)[C@H](N)[C@H](C)c1c(-c2ccccc2)n(C)c2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 2/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ ALDH1A1 P00352 7/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ LMNA P02545 2/20 0.43
▸ HK1 P19367 1/20 0.42
▸ HKDC1 Q2TB90 1/20 0.42
▸ HPGD P15428 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41

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
SCHEMBL10467315 0.84 ALDH1A1 (0.43) HSD17B10CYP2C19ALDH1A1SMN1; SMN2MAPT
SCHEMBL10467546 0.77 TRPM8 (0.45) CYP2C19ALDH1A1SMN1; SMN2RAB9AATM
SCHEMBL13193314 0.72 ALDH1A1 (0.54) HSD17B10CYP2C19ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL19846962 0.72 HSD17B10 (0.60) HSD17B10CYP2C19ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7188506 0.72 GABRA1 (0.45) HSD17B10CYP2C19ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL10468538 0.72 KDM4E (0.48) ALDH1A1L3MBTL1HTTNPSR1LMNA
SCHEMBL10465927 0.72 NR4A2 (0.50) HSD17B10ALDH1A1SMN1; SMN2L3MBTL1MAPT
SCHEMBL22070145 0.71 KDM4E (0.46) HSD17B10CYP2C19ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL12987657 0.70 ALDH1A1 (0.49) HSD17B10CYP2C19ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL6166986 0.69 KMT2A (0.58) HSD17B10ALDH1A1LMNAKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4940709-A PLATELET ACTIVATING FACTOR FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-07-10 — — US disclosed
US-4806538-A ANTICOAGULANT, HYPOTENSIVE AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-02-21 — — US disclosed
EP-0243122-A2 Piperazine compound as PAF-antagonist FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-10-28 — — EP disclosed
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