SCHEMBL11506506

SCHEMBL11506506

CNC1CC(Cl)CC1N(C(=O)[C@@H]1C[C@H]1Cl)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ NPC1 O15118 3/20 0.35
▸ RAB9A P51151 3/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ MITF O75030 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ PAX8 Q06710 1/20 0.35
▸ HTT P42858 3/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ SIGMAR1 Q99720 1/20 0.33
▸ CHRM2 P08172 3/20 0.33
▸ CHRM3 P20309 3/20 0.33
▸ PTGDR2 Q9Y5Y4 2/20 0.33
▸ GPR88 Q9GZN0 2/20 0.33

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
SCHEMBL11507044 1.00 KMT2A (0.35) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL11506505 1.00 KMT2A (0.35) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL11479291 0.88 ALDH1A1 (0.38) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL11479300 0.88 ALDH1A1 (0.38) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL11469344 0.88 ALDH1A1 (0.38) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL11517772 0.83 KMT2A (0.34) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL11517299 0.83 KMT2A (0.34) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL11446751 0.82 SMN1; SMN2 (0.38) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL11443828 0.81 SMN1; SMN2 (0.35) KMT2AALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL11446487 0.81 TP53 (0.44) KMT2AALDH1A1NPC1RAB9ASMN1; 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-4156015-A N-(2-Aminocyclopentyl)acylanilides and treating depression THE UPJOHN COMPANY (US) 1979-05-22 — — US disclosed
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