SCHEMBL11334034

SCHEMBL11334034

CCCC(=O)N(c1ccc(C)cc1)C1CCCCCC1N(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.39
▸ KMT2A Q03164 5/20 0.39
▸ CNR1 P21554 2/20 0.39
▸ CNR2 P34972 2/20 0.39
▸ TSHR P16473 1/20 0.38
▸ CCR1 P32246 1/20 0.37
▸ CCR2 P41597 1/20 0.37
▸ TP53 P04637 1/20 0.36
▸ OPRM1 P35372 1/20 0.35
▸ RAB9A P51151 5/20 0.35
▸ NPC1 O15118 4/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MITF O75030 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ PAX8 Q06710 1/20 0.35
▸ HPGD P15428 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ POLB P06746 2/20 0.34

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
SCHEMBL11446891 0.96 MEN1 (0.40) MEN1KMT2ACNR1CNR2TSHR
SCHEMBL11341133 0.88 RAB9A (0.40) MEN1KMT2ACNR1CNR2RAB9A
SCHEMBL11330415 0.88 KDM4E (0.48) MEN1KMT2ATP53OPRM1RAB9A
SCHEMBL11446524 0.85 MEN1 (0.40) MEN1KMT2ACNR2TSHRTP53
SCHEMBL11446547 0.84 NPC1 (0.38) MEN1KMT2ACNR1CNR2OPRM1
SCHEMBL11446647 0.84 TP53 (0.48) MEN1KMT2ATP53OPRM1RAB9A
SCHEMBL11334030 0.81 CNR2 (0.44) MEN1KMT2ACNR2TSHRRAB9A
SCHEMBL11332175 0.79 SIGMAR1 (0.42) MEN1KMT2ACNR2RAB9ANPC1
SCHEMBL11347007 0.78 SIGMAR1 (0.43) MEN1KMT2ACNR2OPRM1RAB9A
SCHEMBL11331580 0.78 SIGMAR1 (0.41) MEN1KMT2ARAB9ANPC1SMN1; 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 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
Send feedback