SCHEMBL8412937

SCHEMBL8412937

CCNS(=O)(=O)c1ccc2c(c1)CN(C(=O)C(Cc1c[nH]c3ccccc13)OC(=O)C1CCNCC1)CC2

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 2/20 0.39
FPR2 P25090 1/20 0.39
KCNA5 P22460 2/20 0.39
KCNH2 Q12809 1/20 0.39
BAZ2B Q9UIF8 1/20 0.38
F2 P00734 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MMP3 P08254 1/20 0.38
MMP2 P08253 5/20 0.37
MMP9 P14780 5/20 0.37
POLB P06746 1/20 0.37
ECE1 P42892 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
Hydrochloric Acid SCHEMBL6166036 0.85 F2 (0.41) GHSRFPR2KCNA5KCNH2F2
SCHEMBL6170408 0.84 SMYD3 (0.46) BAZ2BMEN1KMT2A
Hydrochloric Acid SCHEMBL6164060 0.83 SMYD3 (0.46) BAZ2BMEN1KMT2A
SCHEMBL6159620 0.79 MEN1 (0.52) GHSRFPR2F2MEN1KMT2A
SCHEMBL6159617 0.79 MEN1 (0.52) GHSRFPR2F2MEN1KMT2A
SCHEMBL6163995 0.79 GHSR (0.46) GHSRF2MMP2MMP9
SCHEMBL6163982 0.79 GHSR (0.46) GHSRF2MMP2MMP9
Hydrochloric Acid SCHEMBL6161046 0.78 GHSR (0.46) GHSRF2MMP2MMP9
Hydrochloric Acid SCHEMBL6161045 0.78 GHSR (0.46) GHSRF2MMP2MMP9
SCHEMBL8409553 0.76 MCL1 (0.50) KCNA5KCNH2F2MEN1KMT2A

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-5936089-A PIPERIDINE DERIVATIVES; BONE DISORDERS; OBESITY; AGING; CACHEXIA ASSOCIATED WITH AIDS AND CANCER PFIZER INC (US) 1999-08-10 US disclosed