SCHEMBL10758263

SCHEMBL10758263

CCC(C(=O)NN)N1CCN(c2cccc(Cl)c2)CC1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
TSHR P16473 1/20 0.53
MAPK1 P28482 1/20 0.53
RECQL P46063 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HTR1A P08908 1/20 0.51
HTR2A P28223 1/20 0.51
HTR7 P34969 1/20 0.51
HTR6 P50406 1/20 0.51
ALDH1A1 P00352 2/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA9 Q16790 1/20 0.47
MAPT P10636 1/20 0.47
ALOX12 P18054 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PANK3 Q9H999 1/20 0.46

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
SCHEMBL10758939 0.84 LMNA (0.52) LMNATSHRNPSR1ALDH1A1MEN1
SCHEMBL10764513 0.84 HTR1A (0.55) LMNATSHRMAPK1RECQLNPSR1
SCHEMBL10759933 0.81 ALDH1A1 (0.56) LMNATSHRMAPK1RECQLNPSR1
SCHEMBL8686716 0.81 LMNA (0.52) LMNATSHRMAPK1RECQLNPSR1
SCHEMBL8957656 0.78 LMNA (0.55) LMNATSHRMAPK1RECQLNPSR1
SCHEMBL30767206 0.78 TSHR (0.57) LMNATSHRMAPK1RECQLNPSR1
SCHEMBL29204363 0.78 TSHR (0.57) LMNATSHRMAPK1RECQLNPSR1
Hydrochloric Acid SCHEMBL10372885 0.75 LMNA (0.54) LMNATSHRMAPK1RECQLNPSR1
SCHEMBL8685769 0.75 LMNA (0.52) LMNATSHRMAPK1RECQLNPSR1
SCHEMBL4255355 0.73 ALDH1A1 (0.59) LMNAHTR1AHTR2AHTR7HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4711885-A N-(N'-phenylpiperazine)-alkyl triazole compounds having anxiolytic and analgesic properties ADIR ET COMPAGNIE (FR) 1987-12-08 US disclosed
US-4575555-A ANTIDEPRESSANTS MEAD JOHNSON & COMPANY (US) 1986-03-11 US disclosed
US-4487773-A ANTISEROTONINE AGENTS MEAD JOHNSON & COMPANY (US) 1984-12-11 US disclosed