SCHEMBL31735850

SCHEMBL31735850

COc1ccc(-c2cc3cc(N)ccc3[nH]2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 9/20 0.65
▸ NPC1 O15118 7/20 0.65
▸ RAB9A P51151 6/20 0.65
▸ MAPT P10636 4/20 0.65
▸ CASP3 P42574 1/20 0.65
▸ SENP8 Q96LD8 1/20 0.65
▸ SENP7 Q9BQF6 1/20 0.65
▸ SENP6 Q9GZR1 1/20 0.65
▸ MEN1 O00255 4/20 0.63
▸ KMT2A Q03164 4/20 0.63
▸ CA12 O43570 1/20 0.60
▸ CA1 P00915 1/20 0.60
▸ CA2 P00918 1/20 0.60
▸ CA9 Q16790 1/20 0.60
▸ ALDH1A1 P00352 8/20 0.52
▸ HPGD P15428 8/20 0.52
▸ SMN1; SMN2 Q16637 6/20 0.52
▸ KCNQ2 O43526 1/20 0.52
▸ HPN P05981 1/20 0.49
▸ GFER P55789 1/20 0.49

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
SCHEMBL4264688 0.87 KDM4E (0.81) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL29513520 0.87 CYP2A6 (0.57) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL1663580 0.85 CYP2A6 (0.55) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL11651810 0.83 KDM4E (0.67) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL28230938 0.82 RAB9A (0.65) KDM4ENPC1RAB9AMAPTMEN1
SCHEMBL15058692 0.79 KDM4E (0.74) KDM4ENPC1RAB9AMAPTCASP3
Formic Acid SCHEMBL28953808 0.79 KDM4E (0.68) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL17199124 0.79 CYP1A1 (0.60) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL17199123 0.79 PDE10A (0.63) KDM4ENPC1RAB9AMAPTCASP3
SCHEMBL2682217 0.79 KDM4E (1.00) KDM4ENPC1RAB9AMAPTCASP3

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
WO-2025245484-A1 FOXN1 ACTIVATORS THYMOFOX INC. (US) 2025-11-27 — — WO disclosed
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