SCHEMBL11706158

SCHEMBL11706158

Cc1cc(Nc2cc(Cl)ccc2C(=O)O)n(C)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
USP2 O75604 1/20 0.47
PABPC1 P11940 1/20 0.47
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GAA P10253 1/20 0.46
KCNH2 Q12809 1/20 0.46
KDM4C Q9H3R0 1/20 0.46
NTRK1 P04629 1/20 0.46
GFER P55789 1/20 0.44
GRIK1 P39086 4/20 0.44
RAB9A P51151 1/20 0.43
AKR1C3 P42330 1/20 0.43
AKR1C2 P52895 1/20 0.43
POLB P06746 1/20 0.43
FTO Q9C0B1 1/20 0.43
MAPT P10636 2/20 0.43
MYC P01106 1/20 0.43

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
SCHEMBL27749271 0.87 TP53 (0.53) MEN1KMT2AUSP2PABPC1KDM4E
SCHEMBL11707284 0.86 CLCN2 (0.47) MEN1KMT2AKDM4ESMN1; SMN2KDM4C
SCHEMBL5012000 0.84 HTT (0.56) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL5253749 0.82 GFER (0.61) MEN1KMT2AUSP2ALDH1A1SMN1; SMN2
SCHEMBL11711434 0.82 MEN1 (0.46) MEN1KMT2AKDM4ESMN1; SMN2GAA
SCHEMBL11709383 0.81 SMN1; SMN2 (0.49) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL27728861 0.80 KMT2A (0.51) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
Trifluoroacetic Acid SCHEMBL27617932 0.79 MAPK1 (0.56) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL5469997 0.78 SMN1; SMN2 (0.47) MEN1KMT2AKDM4ESMN1; SMN2KDM4C
SCHEMBL11713401 0.76 KDM4E (0.48) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2

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
US-4013665-A ANTIVIRAL, SUBSTITUTED 1,3-DIMETHYL-1H-PYRAZOLO(3,4B)QUINOLINES BRISTOL-MYERS COMPANY (US) 1977-03-22 US disclosed