SCHEMBL11570684

SCHEMBL11570684

C=CCN[C@@H]1CC(Cl)C[C@H]1N(C(=O)CCCl)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ MITF O75030 3/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ PAX8 Q06710 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ HTT P42858 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ LMNA P02545 3/20 0.34
▸ CHRM2 P08172 1/20 0.34
▸ CHRM3 P20309 1/20 0.34
▸ NCOA1 Q15788 1/20 0.33
▸ NCOA3 Q9Y6Q9 1/20 0.33
▸ OPRD1 P41143 4/20 0.32
▸ OPRM1 P35372 2/20 0.32
▸ OPRK1 P41145 2/20 0.32

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
SCHEMBL11568723 1.00 KMT2A (0.36) KMT2AALDH1A1MEN1MITFNPC1
SCHEMBL11341461 0.91 KMT2A (0.40) KMT2AALDH1A1MEN1MITFNPC1
SCHEMBL11339668 0.91 KMT2A (0.40) KMT2AALDH1A1MEN1MITFNPC1
SCHEMBL11569546 0.87 HTR1A (0.35) KMT2AALDH1A1MEN1MITFNPC1
SCHEMBL11456609 0.85 ALDH1A1 (0.39) KMT2AALDH1A1MEN1MITFNPC1
SCHEMBL11447348 0.84 ALDH1A1 (0.40) KMT2AALDH1A1MEN1MITFNPC1
SCHEMBL11446728 0.84 ALDH1A1 (0.40) KMT2AALDH1A1MEN1MITFNPC1
SCHEMBL11571084 0.84 CHRM2 (0.40) KMT2AALDH1A1MEN1MITFNPC1
SCHEMBL11516820 0.83 ALDH1A1 (0.38) KMT2AALDH1A1MEN1MITFNPC1
SCHEMBL11518232 0.81 KDM4E (0.38) KMT2AALDH1A1MEN1MITFNPC1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4159340-A N-(2-Aminocyclopentyl)-N-acylanilides as CNS anti-depressants THE UPJOHN COMPANY (US) 1979-06-26 — — US disclosed
US-4159340-A N-(2-Aminocyclopentyl)-N-acylanilides as CNS anti-depressants THE UPJOHN COMPANY (US) 1979-06-26 — — US disclosed
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