SCHEMBL9366719

SCHEMBL9366719

N#CC1C=Cc2cc(F)cc(F)c2N1C(=O)c1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MGLL Q99685 7/20 0.36
▸ HSD11B1 P28845 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.33
▸ F2 P00734 1/20 0.32
▸ PLAU P00749 1/20 0.32
▸ KLKB1 P03952 1/20 0.32
▸ ELANE P08246 1/20 0.32
▸ S1PR3 Q99500 1/20 0.32
▸ HCRTR2 O43614 1/20 0.31
▸ AKR1C3 P42330 1/20 0.31
▸ AKR1C2 P52895 1/20 0.31

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
SCHEMBL9365765 0.86 LMNA (0.44) LMNASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL9365721 0.85 LMNA (0.49) LMNASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL9365734 0.84 LMNA (0.45) LMNASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL9369551 0.83 SMN1; SMN2 (0.58) LMNASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL9366734 0.81 LMNA (0.54) LMNASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL9366700 0.81 MEN1 (0.52) LMNASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL4429170 0.77 LMNA (0.67) LMNASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL9365789 0.75 KMT2A (0.72) LMNASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL29624123 0.75 KMT2A (0.72) LMNASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL9365834 0.74 LMNA (0.49) LMNASMN1; SMN2MEN1ALDH1A1KMT2A

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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