SCHEMBL11225847

SCHEMBL11225847

CCC(=O)Oc1cc(N)c(Cl)c(N)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.46
HIF1A Q16665 2/20 0.46
KMT2A Q03164 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
RECQL P46063 1/20 0.44
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
USP2 O75604 1/20 0.43
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ACHE P22303 3/20 0.42
ELANE P08246 1/20 0.41
ALOX15 P16050 1/20 0.36
CYP3A4 P08684 1/20 0.35
PDGFRB P09619 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
SCHEMBL11229499 0.86 BCL9 (0.44) KMT2AKDM4EALDH1A1USP2GLA
SCHEMBL11321891 0.83 KMT2A (0.41) KMT2ASMN1; SMN2RECQLKDM4EALDH1A1
SCHEMBL11226606 0.82 KMT2A (0.44) KMT2ASMN1; SMN2ALDH1A1HPGDMAPK1
SCHEMBL11315163 0.80 ELANE (0.52) ESR1HIF1AKMT2AKDM4EALDH1A1
SCHEMBL11318429 0.80 KMT2A (0.46) KMT2ASMN1; SMN2ALDH1A1HPGDMAPK1
SCHEMBL25246219 0.79 ESR1 (0.48) ESR1HIF1AKMT2ASMN1; SMN2RECQL
SCHEMBL13720620 0.79 KMT2A (0.48) ESR1HIF1AKMT2ASMN1; SMN2RECQL
SCHEMBL11325105 0.79 CYP19A1 (0.46) KMT2ASMN1; SMN2KDM4EALDH1A1GLA
SCHEMBL7999414 0.78 HPGD (0.49) ESR1HIF1AKMT2ASMN1; SMN2RECQL
SCHEMBL27578640 0.77 ESR1 (0.50) ESR1HIF1AKMT2ASMN1; SMN2RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4327204-A Process for producing polyurethane elastomer by mixing a hardener composition with an isocyanate composition IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1982-04-27 US disclosed
US-4246425-A FOR POLYURETHANE ELASTOMERS, AND PHARMACEUTICAL, AGROCHEMICAL INTERMEDIATE IHARA CHEMICAL INDUSTRY CO., LIMITED (JP) 1981-01-20 US disclosed