SCHEMBL11370328

SCHEMBL11370328

Clc1ccc(C(c2ccccc2)N2CCC(N=Cc3ccc4c(c3)OCO4)CC2)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.59
▸ MAPK1 P28482 1/20 0.59
▸ KMT2A Q03164 6/20 0.44
▸ ALDH1A1 P00352 5/20 0.44
▸ SMN1; SMN2 Q16637 5/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ GAA P10253 2/20 0.44
▸ ADAM17 P78536 1/20 0.44
▸ MCL1 Q07820 1/20 0.44
▸ CNR1 P21554 1/20 0.42
▸ CNR2 P34972 1/20 0.42
▸ HPGD P15428 5/20 0.42
▸ RAB9A P51151 4/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40

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
SCHEMBL11370326 1.00 MAPT (0.59) MAPTMAPK1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11372850 0.91 MAPT (0.69) MAPTMAPK1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11372847 0.91 MAPT (0.69) MAPTMAPK1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11382814 0.89 MAPT (0.57) MAPTMAPK1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11382817 0.89 MAPT (0.57) MAPTMAPK1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11381200 0.86 CNR1 (0.48) MAPTMAPK1CNR1CNR2CYP2D6
SCHEMBL11381203 0.86 CNR1 (0.48) MAPTMAPK1CNR1CNR2CYP2D6
SCHEMBL11373141 0.85 MAPT (0.60) MAPTMAPK1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11373142 0.85 MAPT (0.60) MAPTMAPK1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11376406 0.84 MAPT (0.59) MAPTMAPK1KMT2AALDH1A1SMN1; SMN2

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
US-4267318-A 1-(Diarylmethyl)-4-piperidinamine and derivatives thereof G. D. SEARLE & CO. (US) 1981-05-12 — — US disclosed
Send feedback