SCHEMBL9366567

SCHEMBL9366567

N#CC1C=Cc2ccccc2N1C(=O)/C=C\c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.52
▸ KMT2A Q03164 4/20 0.52
▸ ALDH1A1 P00352 4/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ SMN1; SMN2 Q16637 7/20 0.47
▸ BCHE P06276 1/20 0.42
▸ PTGDR2 Q9Y5Y4 1/20 0.40
▸ RAB9A P51151 4/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ AR P10275 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 2/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ TNKS O95271 1/20 0.37
▸ HDAC4 P56524 1/20 0.37

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
SCHEMBL9366482 1.00 LMNA (0.52) LMNAKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL9366481 1.00 LMNA (0.52) LMNAKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL9365679 0.92 LMNA (0.53) LMNAKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL9365675 0.92 LMNA (0.53) LMNAKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL9365390 0.91 LMNA (0.48) LMNAKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL9365487 0.91 KMT2A (0.48) LMNAKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL9365482 0.91 KMT2A (0.48) LMNAKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL9365498 0.91 LMNA (0.48) LMNAKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL9366552 0.91 ALDH1A1 (0.48) LMNAKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL9366555 0.91 ALDH1A1 (0.48) LMNAKMT2AALDH1A1MEN1SMN1; SMN2

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
EP-0579695-A1 REISSERT COMPOUNDS AS ANTI-HIV AGENTS THE UPJOHN COMPANY (US) 1994-01-26 — — EP claimed
WO-1992016508-A1 REISSERT COMPOUNDS AS ANTI-HIV AGENTS THE UPJOHN COMPANY (US) 1992-10-01 — — WO claimed
EP-0579695-A1 REISSERT COMPOUNDS AS ANTI-HIV AGENTS THE UPJOHN COMPANY (US) 1994-01-26 — — EP disclosed
WO-1992016508-A1 REISSERT COMPOUNDS AS ANTI-HIV AGENTS THE UPJOHN COMPANY (US) 1992-10-01 — — WO disclosed
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