SCHEMBL15330874

SCHEMBL15330874

O=Cc1c(-c2ccccc2F)[nH]c2c(F)cccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.40
FEN1 P39748 1/20 0.39
GSK3A P49840 2/20 0.39
GSK3B P49841 2/20 0.39
ALOX5 P09917 2/20 0.38
AURKA O14965 1/20 0.37
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
AURKB Q96GD4 1/20 0.37
AURKC Q9UQB9 1/20 0.37
MAPK10 P53779 1/20 0.36
RIPK1 Q13546 1/20 0.36
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36
TUBA1B P68363 1/20 0.36
TUBA4A P68366 1/20 0.36
TUBB4B P68371 1/20 0.36
TUBB3 Q13509 1/20 0.36
TUBB2A Q13885 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
SCHEMBL15329887 0.90 TNKS (0.38) CNR1FEN1GSK3AGSK3BALOX5
SCHEMBL2556780 0.89 FEN1 (0.38) CNR1FEN1GSK3AGSK3BALOX5
SCHEMBL15331433 0.88 CDK5 (0.42) GSK3BALOX5CDK5CDK5R1AURKB
SCHEMBL15331095 0.88 CCNB2 (0.42) GSK3BALOX5CDK5CDK5R1TNKS
SCHEMBL15330473 0.88 KMT2A (0.41) CNR1FEN1GSK3AGSK3BALOX5
SCHEMBL15330343 0.85 MAPK13 (0.42) CNR1FEN1GSK3BMEN1KMT2A
SCHEMBL15330688 0.85 CNR1 (0.39) CNR1FEN1MAPK10RIPK1TUBB4A
SCHEMBL15330435 0.85 ALDH1A1 (0.52) ALOX5TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL15332399 0.85 FEN1 (0.37) CNR1FEN1GSK3AGSK3BALOX5
SCHEMBL2560269 0.85 TNKS (0.36) CNR1GSK3BALOX5TUBB4ATUBB

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