SCHEMBL27430453

SCHEMBL27430453

C=Cc1ccc(Cn2ccc(C)c2C)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 3/20 0.49
▸ CA2 P00918 2/20 0.49
▸ F2R P25116 1/20 0.42
▸ MAPT P10636 4/20 0.42
▸ TP53 P04637 4/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ NOTUM Q6P988 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ MMP3 P08254 1/20 0.38
▸ MMP9 P14780 1/20 0.38
▸ XDH P47989 1/20 0.38
▸ POLB P06746 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
SCHEMBL3408453 0.75 LMNA (0.59) CA1CA2F2RMAPTTP53
SCHEMBL17685976 0.73 CA1 (0.61) CA1CA2F2RMAPTTP53
SCHEMBL10874579 0.71 HTR6 (0.64) CA1CA2F2RKMT2AXDH
SCHEMBL6333309 0.70 HPGD (0.67) —
SCHEMBL22028066 0.70 MAPT (0.48) CA1CA2MAPTTP53LMNA
SCHEMBL20333622 0.70 LMNA (0.50) CA1CA2F2RMAPTTP53
SCHEMBL28837179 0.69 ALDH1A1 (0.46) CA1CA2F2RMAPTTP53
SCHEMBL11855385 0.69 MAPT (0.42) CA1CA2MAPTTP53MEN1
SCHEMBL3410893 0.69 CA1 (0.44) CA1CA2F2RMAPTTP53
SCHEMBL19362304 0.68 ALDH1A1 (0.44) CA1CA2F2RMAPTTP53

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
CN-1086196-C Polymerizable benzpyrrole and pyrrole substituted fulgide photochromic material and its synthetic process and use INST PHOTOSENSITIVE CHEMISTRY CAS (CN) 2002-06-12 — — CN disclosed
CN-1213687-A Polymerizable benzpyrrole and pyrrole substituted fulgide photochromic material and its synthetic process and use INST OF PHOTOSOSITIVE CHEMISTR (CN) 1999-04-14 — — CN disclosed
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