SCHEMBL31455897

SCHEMBL31455897

CCCc1cc(OC)c(C=O)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
KDM4E B2RXH2 1/20 0.50
TSHR P16473 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
HPGD P15428 2/20 0.45
LMNA P02545 1/20 0.45
HMGCR P04035 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.42
ERN1 O75460 3/20 0.41
TAAR1 Q96RJ0 2/20 0.39
MAPT P10636 1/20 0.39
PRKDC P78527 1/20 0.39
GAA P10253 1/20 0.38
GPR55 Q9Y2T6 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
SCHEMBL12831232 0.85 ALDH1A1 (0.60) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL630196 0.81 ALDH1A1 (0.51) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL31456012 0.81 ALDH1A1 (0.50) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL31456106 0.79 ALDH1A1 (0.53) ALDH1A1HPGDLMNAHMGCRMAPT
SCHEMBL1187473 0.79 ALDH1A1 (0.65) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL16200303 0.78 ALDH1A1 (0.47) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL26107991 0.77 ALDH1A1 (0.50) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL7401545 0.77 ALDH1A1 (0.69) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL20135982 0.77 ALDH1A1 (0.63) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL31456061 0.77 ERN1 (0.42) ALDH1A1TDP1LMNAHMGCRL3MBTL1

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-2025059373-A1 NOVEL PHENALKYLAMINES AND THEIR USE IN THE TREATMENT OF PSYCHIATRIC DISORDERS GILGAMESH PHARMACEUTICALS, INC. (US) 2025-03-20 WO disclosed