SCHEMBL11338362

SCHEMBL11338362

CN(C)C1CCCCCC1N(C(=O)CCBr)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ MITF O75030 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ PAX8 Q06710 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ PKM P14618 1/20 0.41
▸ MLYCD O95822 1/20 0.41
▸ SIGMAR1 Q99720 2/20 0.39
▸ TRPM8 Q7Z2W7 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ OPRM1 P35372 5/20 0.38
▸ OPRD1 P41143 3/20 0.38
▸ OPRK1 P41145 2/20 0.38
▸ CHRM2 P08172 1/20 0.38
▸ CHRM3 P20309 1/20 0.38
▸ AGTR2 P50052 1/20 0.37

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
SCHEMBL11448317 0.96 ALDH1A1 (0.45) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL11332192 0.90 KDM4E (0.47) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL11331580 0.88 SIGMAR1 (0.41) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL11330415 0.88 KDM4E (0.48) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL11338205 0.87 MITF (0.53) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL11331578 0.87 ALDH1A1 (0.40) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL11333535 0.86 NPC1 (0.44) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL11446669 0.85 ALDH1A1 (0.45) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL11341610 0.85 KDM4E (0.50) KDM4EMEN1NPC1MITFALDH1A1
SCHEMBL11350705 0.85 ALDH1A1 (0.45) KDM4EMEN1NPC1MITFALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4156014-A N-(2-aminocycloheptyl)alkanoylanilides and in the treatment of depression THE UPJOHN COMPANY (US) 1979-05-22 — — US claimed
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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