Morclofone

Morclofone

SCHEMBL28086404

CN1CCCC(=C(c2cccs2)c2cccs2)C1.COc1cc(C(=O)c2ccc(Cl)cc2)cc(OC)c1OCCN1CCOCC1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
LMNA P02545 1/20 0.41
SYK P43405 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KCNA5 P22460 5/20 0.40
MEN1 O00255 2/20 0.39
PAX8 Q06710 1/20 0.39
TSHR P16473 2/20 0.37
CYP2D6 P10635 1/20 0.37
ALDH1A1 P00352 2/20 0.36
USP2 O75604 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
KDM4E B2RXH2 2/20 0.36
TP53 P04637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PTGS2 P35354 1/20 0.36

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
Morclofone SCHEMBL554800 0.82 SYK (0.60) KMT2ALMNASYKSMN1; SMN2KCNA5
Tipepidine SCHEMBL410090 0.68 NOS3 (0.43) KMT2ALMNASMN1; SMN2MEN1TSHR
SCHEMBL4711038 0.68 SYK (0.70) KMT2ASYKSMN1; SMN2MEN1TSHR
Tipepidine SCHEMBL30827547 0.67 NOS3 (0.42) KMT2ALMNASMN1; SMN2MEN1TSHR
SCHEMBL2088816 0.67 SYK (0.68) KMT2ALMNASYKSMN1; SMN2MEN1
Tipepidine SCHEMBL11026418 0.67 HPGDS (0.43) KMT2ALMNASMN1; SMN2MEN1TSHR
SCHEMBL23195558 0.64 KDM4E (0.61) KMT2ALMNASYKSMN1; SMN2MEN1
SCHEMBL3930808 0.64 KDM4E (0.61) LMNASYKSMN1; SMN2TSHRCYP2D6
SCHEMBL17610025 0.63 ALDH1A1 (0.55) KMT2ATSHRALDH1A1MAPTKDM4E
SCHEMBL24177757 0.62 LMNA (0.97) KMT2ALMNASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103717597-B Heterocyclic compounds as kinase inhibitors 原真股份有限公司 2017-07-04 CN disclosed
CN-103492389-B Pyrazolo [4,3-d] pyrimidine as inhibitors of kinases 原真股份有限公司 2016-09-14 CN disclosed