SCHEMBL23473327

SCHEMBL23473327

CC1CC(C)CN(c2ccc(-c3cc(=O)c4ccc(N=O)c(O)c4o3)cc2)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 10/20 0.45
▸ CYP1A1 P04798 2/20 0.43
▸ CYP1B1 Q16678 2/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ CYP3A4 P08684 3/20 0.42
▸ MAPT P10636 3/20 0.42
▸ HPGD P15428 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ TP53 P04637 2/20 0.42
▸ ALOX15 P16050 2/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ CYP19A1 P11511 2/20 0.42
▸ BRD4 O60885 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ IKBKB O14920 1/20 0.42
▸ MAOA P21397 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ NTRK2 Q16620 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
SCHEMBL21647154 0.87 TERT (0.60) TERTCYP1A1CYP1B1ALDH1A1CYP3A4
SCHEMBL23473366 0.86 TERT (0.45) TERTCYP1A1CYP1B1ALDH1A1CYP3A4
SCHEMBL23473437 0.70 USP8 (0.58) TERTCYP1A1CYP1B1CYP3A4CYP2C19
SCHEMBL22789421 0.69 TERT (0.66) TERTCYP1A1CYP1B1ALDH1A1CYP3A4
SCHEMBL21647173 0.69 TERT (0.66) TERTCYP1A1CYP1B1ALDH1A1CYP3A4
SCHEMBL22772266 0.69 TERT (0.62) TERTCYP1A1CYP1B1ALDH1A1CYP3A4
SCHEMBL21647175 0.68 TERT (0.60) TERTCYP1A1CYP1B1ALDH1A1CYP3A4
SCHEMBL23473424 0.68 USP8 (0.56) TERTCYP1A1CYP1B1ALDH1A1CYP3A4
SCHEMBL21647164 0.68 TERT (0.57) TERTCYP1A1CYP1B1ALDH1A1CYP3A4
SCHEMBL21647151 0.68 TERT (0.57) TERTCYP1A1CYP1B1ALDH1A1CYP3A4

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-3831821-A1 COMPOUND FOR TREATING NERVOUS SYSTEM DISEASES AND USE THEREOF Shaanxi Micot Technology Limited Company (CN) 2021-06-09 — — EP disclosed
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