SCHEMBL17929336

SCHEMBL17929336

CCCc1ccc(C(=O)Cc2cnc(-c3ccc(OC(C)=O)cc3)nc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.50
▸ THRB P10828 3/20 0.50
▸ SMN1; SMN2 Q16637 6/20 0.49
▸ RAB9A P51151 3/20 0.44
▸ TP53 P04637 2/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ RARB P10826 1/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ KMT2A Q03164 4/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ CACNA1B Q00975 1/20 0.41
▸ APBA1 Q02410 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ PLA2G1B P04054 1/20 0.38
▸ ATG4B Q9Y4P1 1/20 0.38
▸ ACACB O00763 1/20 0.38
▸ ACACA Q13085 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ USP2 O75604 1/20 0.38

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
SCHEMBL9271331 0.86 MAPT (0.49) MAPTTHRBSMN1; SMN2RAB9ATP53
SCHEMBL5669096 0.86 THRB (0.53) MAPTTHRBSMN1; SMN2RAB9ANPC1
SCHEMBL17931043 0.85 ELANE (0.51) MAPTSMN1; SMN2RAB9ANPC1HSD17B10
SCHEMBL10306589 0.84 MAPT (0.60) MAPTTHRBSMN1; SMN2RAB9ATP53
SCHEMBL9817392 0.78 MAPT (0.67) MAPTTHRBSMN1; SMN2RAB9ATP53
SCHEMBL9266037 0.78 MAPT (0.54) MAPTTHRBSMN1; SMN2RAB9ANPC1
SCHEMBL3899589 0.77 THRB (0.66) MAPTTHRBSMN1; SMN2RAB9ANPC1
SCHEMBL9265474 0.77 MAPT (0.56) MAPTTHRBSMN1; SMN2RAB9ANPC1
SCHEMBL11307746 0.76 MAPT (0.67) MAPTTHRBSMN1; SMN2RAB9ATP53
SCHEMBL11785681 0.76 THRB (0.64) MAPTTHRBSMN1; SMN2RAB9ANPC1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160209561-A1 Photochromic Articles That Include Photochromic-Dichroic Materials TRANSITIONS OPTICAL, INC. 2016-07-21 — — US disclosed
Send feedback