SCHEMBL11499971

SCHEMBL11499971

CCOC(=O)N(c1ccc(C)c(Cl)c1)C1CCCCCC1N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TACR1 P25103 2/20 0.39
▸ OPRM1 P35372 1/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ SMN1; SMN2 Q16637 5/20 0.37
▸ RAB9A P51151 4/20 0.37
▸ NPC1 O15118 3/20 0.37
▸ TSHR P16473 2/20 0.37
▸ HTT P42858 1/20 0.37
▸ EPHX2 P34913 1/20 0.37
▸ MAPK1 P28482 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ SLC6A4 P31645 1/20 0.35
▸ TAS1R3 Q7RTX0 1/20 0.35
▸ TAS1R1 Q7RTX1 1/20 0.35

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
SCHEMBL11559949 0.97 TACR1 (0.40) TACR1OPRM1L3MBTL1MEN1KMT2A
SCHEMBL11378463 0.80 TACR1 (0.44) TACR1OPRM1MEN1KMT2AALDH1A1
SCHEMBL10911997 0.76 TACR1 (0.53) TACR1OPRM1MEN1KMT2AALDH1A1
SCHEMBL11498170 0.76 TACR1 (0.44) TACR1OPRM1MEN1KMT2AALDH1A1
SCHEMBL11549690 0.72 OPRD1 (0.42) OPRM1MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6492800 0.71 LMNA (0.50) KMT2AALDH1A1SMN1; SMN2RAB9ANPC1
SCHEMBL11561433 0.70 TP53 (0.37) MEN1KMT2AALDH1A1ATMGAA
SCHEMBL11404600 0.70 ALDH1A1 (0.49) TACR1OPRM1MEN1KMT2AALDH1A1
SCHEMBL11454751 0.69 OPRD1 (0.43) OPRM1MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11550476 0.68 RAB9A (0.39) OPRM1MEN1KMT2AALDH1A1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4199589-A N-(2-Aminocycloheptyl)acylanilides and methods to treat depression SZMUSZKOVICZ JACOB (US) 1980-04-22 — — US disclosed
US-4172898-A N-(2-aminocycloheptyl)acylanilides THE UPJOHN COMPANY (US) 1979-10-30 — — US disclosed
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