SCHEMBL19984011

SCHEMBL19984011

CCOc1cc(F)c(Nc2ccc3c(CNC)cn(Sc4cccnc4)c3c2)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.34
TSHR P16473 1/20 0.32
NAMPT P43490 1/20 0.32
SYK P43405 1/20 0.32
BUB1 O43683 7/20 0.32
ALDH1A1 P00352 2/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
PKM P14618 1/20 0.32
GAA P10253 1/20 0.31
TP53 P04637 1/20 0.31
POLB P06746 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
GRM4 Q14833 1/20 0.31
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.30
MAP3K8 P41279 1/20 0.30
CSF1R P07333 1/20 0.30

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
SCHEMBL19983848 0.89 MAP3K8 (0.32) EGFRMAPTKMT2AMEN1MAP3K8
SCHEMBL19984199 0.86 MAP3K8 (0.31) EGFRMAPTKMT2AMEN1MAP3K8
SCHEMBL19983844 0.83 ALDH1A1 (0.35) NAMPTALDH1A1KDM4EMAPTPOLB
SCHEMBL19983721 0.83 HTR2C (0.32) NAMPTMAPTKMT2AMEN1
SCHEMBL19984241 0.82 RAPGEF4 (0.32) ALDH1A1TDP1
SCHEMBL19983826 0.82 ABCG2 (0.37) KDM4EGAAKMT2A
SCHEMBL19984007 0.81 MAT2A (0.34) SYKNPC1RAB9A
SCHEMBL19984177 0.81 HTR2C (0.39) ALDH1A1KMT2A
SCHEMBL19984087 0.81 SLC6A2 (0.34) EGFRMAP3K8
SCHEMBL16626710 0.80 NAMPT (0.38) TSHRNAMPTMAPTTP53

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-3052484-B1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAE WOONG PHARMA (KR) 2018-03-21 EP disclosed