SCHEMBL8342323

SCHEMBL8342323

N#CC1C=Cc2ccccc2N1C(=O)c1ccc(F)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.72
▸ KMT2A Q03164 5/20 0.72
▸ MEN1 O00255 4/20 0.72
▸ ALDH1A1 P00352 4/20 0.72
▸ SMN1; SMN2 Q16637 5/20 0.60
▸ NPSR1 Q6W5P4 3/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ P2RX4 Q99571 1/20 0.39
▸ HSD11B1 P28845 4/20 0.38
▸ ATM Q13315 2/20 0.38
▸ HPGD P15428 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ L3MBTL1 Q9Y468 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
SCHEMBL8342494 0.89 LMNA (0.75) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL9369302 0.88 LMNA (0.78) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL9365388 0.87 LMNA (0.72) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL29624123 0.87 KMT2A (0.72) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL9365729 0.87 LMNA (0.72) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL9365789 0.87 KMT2A (0.72) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL8343305 0.86 LMNA (0.68) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL8342786 0.86 LMNA (0.68) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL9365701 0.84 LMNA (0.79) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL9366677 0.84 ALDH1A1 (1.00) LMNAKMT2AMEN1ALDH1A1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5939435-A TREATMENT OF ATHEROSCLEROSIS AND CORONARY HEART DISEASE AMERICAN HOME PRODUCTS CORPORATION (US) 1999-08-17 — — US disclosed
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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