SCHEMBL15330348

SCHEMBL15330348

Cn1nc(-c2cccc(Cl)c2Cl)c(C=O)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PTPN11 Q06124 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2D6 P10635 1/20 0.37
MAOA P21397 1/20 0.37
MAPK1 P28482 1/20 0.37
ADRA1A P35348 1/20 0.37
SCN4A P35499 1/20 0.37
BLM P54132 1/20 0.37
PMP22 Q01453 1/20 0.37
PDE3A Q14432 1/20 0.37
SCN5A Q14524 1/20 0.37
SCN9A Q15858 1/20 0.37
SCN2A Q99250 1/20 0.37
SCN3A Q9NY46 1/20 0.37

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
SCHEMBL15331588 0.88 MAPT (0.43) ALDH1A1MEN1KMT2ATDP1CYP1A2
SCHEMBL15329706 0.86 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ATDP1CYP1A2
SCHEMBL15332533 0.86 MEN1 (0.40) ALDH1A1MEN1KMT2ATDP1PTPN11
SCHEMBL17290558 0.86 MEN1 (0.40) ALDH1A1MEN1KMT2ATDP1PTPN11
SCHEMBL15332751 0.82 ALDH1A1 (0.39) ALDH1A1MEN1KMT2ATDP1PTPN11
SCHEMBL15329967 0.81 CYP1A2 (0.39) ALDH1A1TDP1CYP1A2CYP2C9CYP2C19
SCHEMBL16963178 0.80 CYP1A2 (0.36) ALDH1A1MEN1KMT2ATDP1CYP1A2
SCHEMBL2558228 0.80 KMT2A (0.40) ALDH1A1MEN1KMT2ATDP1CYP1A2
SCHEMBL2555076 0.80 CYP1A2 (0.37) ALDH1A1MEN1KMT2ATDP1PTPN11
SCHEMBL29952633 0.80 CYP1A2 (0.37) ALDH1A1MEN1KMT2ATDP1PTPN11

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