SCHEMBL7962078

SCHEMBL7962078

CCOC(=O)n1ccc2c(C(=O)c3ccc(C(=O)N(C)c4ccc(C)cc4OCCCCCC(=O)N4CCN(C)CC4)c(N)c3OC)cccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
MAPT P10636 3/20 0.35
USP2 O75604 1/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
AVPR2 P30518 1/20 0.34
AVPR1A P37288 1/20 0.34
HPGD P15428 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CBX7 O95931 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
HTR4 Q13639 5/20 0.32
NPC1 O15118 2/20 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
Hydrochloric Acid SCHEMBL7482468 0.99 RAB9A (0.35) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7598802 0.87 HTR6 (0.38) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7478475 0.86 CBX7 (0.38) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7475353 0.85 MEN1 (0.35) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7781332 0.84 KMT2A (0.39) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7476401 0.84 MEN1 (0.35) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7340721 0.84 AVPR2 (0.39) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7486482 0.83 RAB9A (0.35) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7476546 0.82 MEN1 (0.34) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL7962073 0.82 AVPR2 (0.38) RAB9ASMN1; SMN2KMT2AAVPR2AVPR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6207693-B1 Benzamide derivatives having a vasopressin antagonistic activity FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-03-27 US disclosed