SCHEMBL9703748

SCHEMBL9703748

SCC=Cc1cccnc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.59
CYP11B1 P15538 1/20 0.59
CHRNB2 P17787 2/20 0.57
CHRNA4 P43681 2/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
CHRNB4 P30926 1/20 0.57
CHRNA3 P32297 1/20 0.57
CHRNA7 P36544 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57
ALOX15 P16050 1/20 0.57
CYP2C19 P33261 1/20 0.57
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
KDM4E B2RXH2 1/20 0.52
JUN P05412 1/20 0.52
MAPT P10636 1/20 0.52
NFKB1 P19838 1/20 0.52
MAPK1 P28482 1/20 0.52

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
SCHEMBL9703558 0.85 CHRNB2 (0.63) CYP11B2CYP11B1CHRNB2CHRNA4MEN1
SCHEMBL7099087 0.82 CYP11B2 (0.61) CYP11B2CYP11B1CHRNB2CHRNA4MEN1
SCHEMBL7099093 0.82 CYP11B2 (0.61) CYP11B2CYP11B1CHRNB2CHRNA4MEN1
SCHEMBL29691623 0.80 CYP11B1 (0.86) CYP11B2CYP11B1CHRNB2CHRNA4MEN1
SCHEMBL29691639 0.80 CYP11B1 (0.86) CYP11B2CYP11B1CHRNB2CHRNA4MEN1
SCHEMBL6132904 0.80 CYP11B2 (0.59) CYP11B2CYP11B1CHRNB2CHRNA4MEN1
Hydrochloric Acid SCHEMBL6855610 0.80 CYP11B2 (0.59) CYP11B2CYP11B1CHRNB2CHRNA4MEN1
SCHEMBL9703739 0.80 CYP11B2 (0.59) CYP11B2CYP11B1CHRNB2CHRNA4MEN1
SCHEMBL22714727 0.80 CHRNB2 (0.62) CYP11B2CYP11B1CHRNB2CHRNA4MEN1
SCHEMBL9703744 0.80 CYP11B2 (0.59) CYP11B2CYP11B1CHRNB2CHRNA4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103483154-A Process for producing bisphenol compound MITSUBISHI CHEM CORP 2014-01-01 CN claimed
CN-102292311-A Process for producing bisphenol compound 2011-12-21 CN claimed
CN-103483154-B Process for producing bisphenol compound 三菱化学株式会社 2016-07-06 CN disclosed
CN-103483154-A Process for producing bisphenol compound MITSUBISHI CHEM CORP 2014-01-01 CN disclosed
CN-102292311-A Process for producing bisphenol compound 2011-12-21 CN disclosed
EP-0192210-B1 CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-10-21 EP disclosed
US-4973699-A Cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-11-27 US disclosed
US-4861769-A Cephem compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-08-29 US disclosed
EP-0192210-A2 Cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-08-27 EP disclosed