SCHEMBL22080375

SCHEMBL22080375

CSc1ccc(Cc2ccc(Cl)cc2)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
RAB9A P51151 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
RECQL P46063 1/20 0.46
LMNA P02545 1/20 0.45
MAPT P10636 3/20 0.45
ALDH1A1 P00352 2/20 0.43
NPC1 O15118 1/20 0.43
SLC6A2 P23975 3/20 0.42
SLC6A4 P31645 3/20 0.42
SLC6A3 Q01959 3/20 0.42
MAPK1 P28482 2/20 0.41
HSD17B10 Q99714 1/20 0.41
SLC5A2 P31639 2/20 0.40
SLC5A1 P13866 1/20 0.40
CYP3A4 P08684 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38

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
SCHEMBL11722438 0.79 IDO1 (0.56) MEN1KMT2ARAB9ACYP1A2CYP2C9
SCHEMBL6299575 0.76 ALDH1A1 (0.42) MEN1KMT2ARAB9ACYP1A2CYP2C9
SCHEMBL12164468 0.76 ALDH1A1 (0.45) MEN1KMT2ARAB9ACYP1A2CYP2C9
SCHEMBL5672563 0.74 ALDH1A1 (0.41) KMT2ARAB9ACYP1A2CYP2C9CYP2C19
SCHEMBL1149063 0.73 MAPT (0.49) MEN1KMT2ARAB9AMAPTALDH1A1
SCHEMBL22648118 0.71 ALDH1A1 (0.39) MEN1KMT2ARAB9ACYP1A2CYP2C9
SCHEMBL15359017 0.71 MAPK1 (0.42) MEN1KMT2ARAB9ACYP1A2CYP2C9
SCHEMBL1539303 0.70 SLC5A2 (0.50) MEN1KMT2ARAB9ACYP1A2CYP2C9
SCHEMBL96393 0.70
SCHEMBL6282006 0.69 SMN1; SMN2 (0.52) MEN1KMT2ARAB9ACYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020117759-A1 SMALL MOLECULE DEGRADERS OF HELIOS AND METHODS OF USE DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-06-11 WO disclosed