SCHEMBL9365679

SCHEMBL9365679

Cc1ccc(C=CC(=O)N2c3ccccc3C=CC2C#N)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.53
▸ SMN1; SMN2 Q16637 4/20 0.53
▸ ALDH1A1 P00352 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ MAPT P10636 8/20 0.43
▸ HPGD P15428 3/20 0.40
▸ TRPM8 Q7Z2W7 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ GPR183 P32249 1/20 0.40
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ CYP1B1 Q16678 1/20 0.37
▸ PTGDR2 Q9Y5Y4 1/20 0.36
▸ AR P10275 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
SCHEMBL9365675 1.00 LMNA (0.53) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL9366481 0.92 LMNA (0.52) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL9366482 0.92 LMNA (0.52) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL9366567 0.92 LMNA (0.52) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL9365487 0.90 KMT2A (0.48) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL9366555 0.90 ALDH1A1 (0.48) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL9366552 0.90 ALDH1A1 (0.48) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL9365482 0.90 KMT2A (0.48) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL9365498 0.90 LMNA (0.48) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL9365390 0.90 LMNA (0.48) LMNASMN1; SMN2ALDH1A1KMT2AMEN1

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 2 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 disclosed
WO-1992016508-A1 REISSERT COMPOUNDS AS ANTI-HIV AGENTS THE UPJOHN COMPANY (US) 1992-10-01 — — WO disclosed
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