SCHEMBL15329613

SCHEMBL15329613

O=Cc1c(-c2ccc(F)cc2)nn(-c2cccc(F)c2)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
LMNA P02545 1/20 0.38
ESR1 P03372 1/20 0.37
SRC P12931 2/20 0.36
BRAF P15056 2/20 0.36
KDR P35968 2/20 0.36
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
MAPK14 Q16539 1/20 0.36
GAA P10253 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CDK1 P06493 1/20 0.35
CDK4 P11802 1/20 0.35
CCNB1 P14635 1/20 0.35
CCNA2 P20248 1/20 0.35
CCND1 P24385 1/20 0.35
CDK2 P24941 1/20 0.35
CDK7 P50613 1/20 0.35
CCNH P51946 1/20 0.35

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
SCHEMBL2558707 0.94 GAA (0.40) POLBLMNAESR1SRCBRAF
SCHEMBL15330467 0.92 POLB (0.43) POLBLMNAESR1SRCBRAF
SCHEMBL15329733 0.92 POLB (0.40) POLBESR1IDO1TDO2MAPK14
SCHEMBL29956177 0.91 ESR1 (0.38) ESR1IDO1TDO2GAAALDH1A1
SCHEMBL2557255 0.90 ESR1 (0.37) POLBLMNAESR1IDO1TDO2
SCHEMBL2558886 0.89 AHR (0.35) POLBLMNAESR1IDO1TDO2
SCHEMBL2561813 0.88 POLB (0.40) POLBLMNASRCBRAFKDR
SCHEMBL11725935 0.88 POLB (0.52) POLBLMNASRCBRAFKDR
SCHEMBL2559025 0.88 KMT2A (0.39) POLBLMNAESR1IDO1TDO2
SCHEMBL15329873 0.87 CYP1A2 (0.44) SRCBRAFKDRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed