SCHEMBL8022930

SCHEMBL8022930

C=CC(=O)O/C(=C(\C#N)c1nc(-c2ccccc2)cs1)c1ccccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.51
ALDH1A1 P00352 6/20 0.51
POLB P06746 2/20 0.51
RAB9A P51151 5/20 0.44
NPC1 O15118 3/20 0.44
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
HIF1A Q16665 1/20 0.43
MEN1 O00255 7/20 0.42
KMT2A Q03164 7/20 0.42
CYP1A2 P05177 4/20 0.42
CYP2C19 P33261 4/20 0.42
CYP3A4 P08684 3/20 0.42
CYP2C9 P11712 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HCRTR1 O43613 1/20 0.42
USP2 O75604 1/20 0.42
ALOX15 P16050 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL8022931 1.00 MAPT (0.51) MAPTALDH1A1POLBRAB9ANPC1
SCHEMBL8032632 0.85 MAPT (0.50) MAPTALDH1A1POLBRAB9ANPC1
SCHEMBL8032635 0.85 MAPT (0.50) MAPTALDH1A1POLBRAB9ANPC1
SCHEMBL8036552 0.79 MAPT (0.63) MAPTALDH1A1POLBRAB9ANPC1
SCHEMBL8036557 0.79 MAPT (0.63) MAPTALDH1A1POLBRAB9ANPC1
Dimethylamine SCHEMBL11274153 0.76 MAPT (0.58) MAPTALDH1A1POLBRAB9ANPC1
SCHEMBL8032655 0.75 MRE11 (0.35) MAPTALDH1A1POLBRAB9ANPC1
SCHEMBL8032651 0.75 MRE11 (0.35) MAPTALDH1A1POLBRAB9ANPC1
SCHEMBL8036678 0.74 HPGD (0.40) MAPTALDH1A1RAB9AKMT2ACYP1A2
SCHEMBL8036674 0.74 HPGD (0.40) MAPTALDH1A1RAB9AKMT2ACYP1A2

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
EP-0983997-A1 RESINS FOR ANTIFOULING AGENTS AGAINST PERIPHYTONS, PROCESS FOR THE PREPARATION OF THE RESINS, AND ANTIFOULING AGENTS AGAINST PERIPHYTONS CONTAINING THE SAME IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) 2000-03-08 EP disclosed