SCHEMBL11338296

SCHEMBL11338296

CC1C(Br)CC1C(=O)N(c1ccccc1)C1CCCCCC1N(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ PKM P14618 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ MITF O75030 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ PAX8 Q06710 1/20 0.38
▸ TRPM8 Q7Z2W7 3/20 0.36
▸ ATM Q13315 1/20 0.35
▸ LMNA P02545 3/20 0.33
▸ TSHR P16473 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ ABCC1 P33527 1/20 0.32
▸ MAPT P10636 2/20 0.32
▸ TP53 P04637 1/20 0.32
▸ THRB P10828 1/20 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
SCHEMBL11466004 0.96 ALDH1A1 (0.36) ALDH1A1MEN1KMT2APKMSMN1; SMN2
SCHEMBL11331824 0.81 PKM (0.39) ALDH1A1MEN1KMT2APKMSMN1; SMN2
SCHEMBL11332174 0.81 ALDH1A1 (0.42) ALDH1A1MEN1KMT2APKMSMN1; SMN2
SCHEMBL11455130 0.78 MEN1 (0.39) ALDH1A1MEN1KMT2APKMSMN1; SMN2
SCHEMBL11446586 0.77 ALDH1A1 (0.40) ALDH1A1MEN1KMT2APKMSMN1; SMN2
SCHEMBL11341256 0.77 MEN1 (0.43) ALDH1A1MEN1KMT2APKMSMN1; SMN2
SCHEMBL11331790 0.76 ALDH1A1 (0.47) ALDH1A1MEN1KMT2APKMSMN1; SMN2
SCHEMBL11341151 0.74 MEN1 (0.40) ALDH1A1MEN1KMT2APKMSMN1; SMN2
SCHEMBL11333539 0.74 ALDH1A1 (0.38) ALDH1A1MEN1KMT2APKMSMN1; SMN2
SCHEMBL11330704 0.73 ALDH1A1 (0.39) ALDH1A1MEN1KMT2APKMSMN1; 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 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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