SCHEMBL32659964

SCHEMBL32659964

COc1ccc(C(N)c2ccc(C)o2)c(N2CCC(C)CC2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ HTT P42858 3/20 0.36
▸ MAPT P10636 3/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ GAA P10253 3/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ CASP7 P55210 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ POLB P06746 2/20 0.35
▸ HPGD P15428 3/20 0.35
▸ TSHR P16473 3/20 0.35
▸ USP2 O75604 1/20 0.35
▸ HTR3E A5X5Y0 1/20 0.34
▸ HTR3B O95264 1/20 0.34

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
Hydrochloric Acid SCHEMBL20424810 0.99 ALDH1A1 (0.36) ALDH1A1KMT2AKDM4EHTTMAPT
SCHEMBL20424558 0.87 KMT2A (0.39) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL20424764 0.87 KMT2A (0.39) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL23683804 0.87 FFAR1 (0.35) ALDH1A1KMT2AKDM4EMAPTGAA
Hydrochloric Acid SCHEMBL20424703 0.86 FFAR1 (0.35) ALDH1A1KMT2AKDM4EMAPTGAA
SCHEMBL23589253 0.86 PRKDC (0.46) ALDH1A1KMT2AKDM4EHTTMAPT
Hydrochloric Acid SCHEMBL20424423 0.85 PRKDC (0.45) ALDH1A1KMT2AKDM4EHTTMAPT
SCHEMBL23683833 0.83 PKM (0.35) ALDH1A1KMT2AKDM4EMAPTMEN1
Hydrochloric Acid SCHEMBL20424938 0.82 MAPT (0.36) ALDH1A1KMT2AKDM4EMAPTMEN1
SCHEMBL23683810 0.79 MAPT (0.33) ALDH1A1KMT2AKDM4EHTTMAPT

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-3573972-B1 RORGAMMA MODULATORS AND USES THEREOF GENFIT (FR) 2026-01-14 — — EP disclosed
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