SCHEMBL15329690

SCHEMBL15329690

O=Cc1c(-c2ccccc2F)[nH]c2ccc(Cl)cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.46
CCNB2 O95067 1/20 0.43
CDK1 P06493 1/20 0.43
CCNB1 P14635 1/20 0.43
GSK3B P49841 1/20 0.43
CDK5 Q00535 1/20 0.43
CDK5R1 Q15078 1/20 0.43
CCNB3 Q8WWL7 1/20 0.43
PTGS2 P35354 4/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
RXFP1 Q9HBX9 1/20 0.43
GABRP O00591 1/20 0.41
GABRD O14764 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB1 P18505 1/20 0.41
GABRG2 P18507 1/20 0.41
GABRB3 P28472 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41

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
SCHEMBL15330490 0.90 AHR (0.42) AHRCCNB2CDK1CCNB1GSK3B
SCHEMBL15329752 0.86 MEN1 (0.41) AHRCCNB2CDK1CCNB1GSK3B
SCHEMBL2558384 0.86 PTGS2 (0.53) AHRCCNB2CDK1CCNB1GSK3B
SCHEMBL15330837 0.86 KDM4E (0.48) CCNB2CDK1CCNB1GSK3BCDK5
SCHEMBL15331867 0.85 PIM1 (0.41) AHRPTGS2MEN1KMT2ARXFP1
SCHEMBL15331496 0.85 AHR (0.44) AHRGSK3BPTGS2MEN1KMT2A
SCHEMBL15332384 0.84 MAP2 (0.52) AHRCCNB2CDK1CCNB1GSK3B
SCHEMBL15331165 0.84 MEN1 (0.46) CCNB2CDK1CCNB1GSK3BCDK5
SCHEMBL15330747 0.81 MAP2 (0.42) GSK3BKMT2AGABRPGABRDGABRA1
SCHEMBL15332126 0.81 ALDH1A1 (0.50) AHRCCNB2CDK1CCNB1GSK3B

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