SCHEMBL11247737

SCHEMBL11247737

Cc1c(F)c(F)cc(Oc2ncccc2C(=O)Nc2ccc(F)cc2)c1F

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.64
AHR P35869 1/20 0.48
KDR P35968 1/20 0.48
NPC1 O15118 1/20 0.47
TSHR P16473 1/20 0.47
LMNA P02545 1/20 0.46
ALDH1A1 P00352 1/20 0.46
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
PDE4A P27815 1/20 0.45
PDE4B Q07343 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
RECQL P46063 1/20 0.44
PPARG P37231 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
NCOR2 Q9Y618 1/20 0.44

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
SCHEMBL11250348 0.88 L3MBTL1 (0.50) KMT2ANPC1TSHRLMNAMEN1
SCHEMBL6452431 0.87 KMT2A (0.61) KMT2AKDM4EMEN1CYP1A2CYP2C19
SCHEMBL11234692 0.87 KMT2A (0.47) KMT2ALMNAKDM4EMEN1CYP1A2
SCHEMBL10975208 0.80 KMT2A (0.66) KMT2AAHRKDRNPC1TSHR
SCHEMBL11238903 0.80 MET (0.45) KMT2AALDH1A1CYP2C19PDE4APDE4B
SCHEMBL10968907 0.79 KMT2A (0.74) KMT2AKDRNPC1TSHRKDM4E
SCHEMBL10972052 0.77 KMT2A (0.80) KMT2AKDRALDH1A1KDM4EMEN1
SCHEMBL10971030 0.77 KMT2A (0.75) KMT2AKDRNPC1KDM4EMEN1
SCHEMBL10972474 0.76 KMT2A (0.70) KMT2AKDRNPC1TSHRKDM4E
SCHEMBL6370531 0.76 MAPT (0.54) KMT2ANPC1LMNAALDH1A1KDM4E

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
EP-0053011-A1 New herbicidal nicotinamide derivatives MAY & BAKER LIMITED (GB) 1982-06-02 EP disclosed