SCHEMBL11334030

SCHEMBL11334030

CCCC(=O)N(c1ccc(Cl)cc1)C1CCCCCC1N(CC)CC

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.44
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ SIGMAR1 Q99720 1/20 0.39
▸ TSHR P16473 2/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ MITF O75030 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ PAX8 Q06710 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ SLC6A2 P23975 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ CYP3A4 P08684 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
SCHEMBL11447042 0.96 MEN1 (0.39) CNR2MEN1KMT2ASIGMAR1TSHR
SCHEMBL11341323 0.91 CNR2 (0.43) CNR2MEN1KMT2ASIGMAR1TSHR
SCHEMBL11446987 0.87 CNR2 (0.39) CNR2MEN1KMT2ASIGMAR1TSHR
SCHEMBL11446524 0.87 MEN1 (0.40) CNR2MEN1KMT2ASIGMAR1TSHR
SCHEMBL11550114 0.84 CNR2 (0.39) CNR2MEN1KMT2ASIGMAR1TSHR
SCHEMBL11434897 0.83 MEN1 (0.39) CNR2MEN1KMT2ASIGMAR1TSHR
SCHEMBL11332175 0.81 SIGMAR1 (0.42) CNR2MEN1KMT2ASIGMAR1KDM4E
SCHEMBL11334034 0.81 MEN1 (0.39) CNR2MEN1KMT2ATSHRKDM4E
SCHEMBL11347007 0.80 SIGMAR1 (0.43) CNR2MEN1KMT2ASIGMAR1KDM4E
SCHEMBL11447832 0.80 DRD2 (0.36) CNR2MEN1KMT2ASIGMAR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE30837-E ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1981-12-29 — — US disclosed
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
US-4169156-A ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1979-09-25 — — US disclosed
US-4159339-A ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1979-06-26 — — US disclosed
US-4156014-A N-(2-aminocycloheptyl)alkanoylanilides and in the treatment of depression THE UPJOHN COMPANY (US) 1979-05-22 — — US disclosed
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