SCHEMBL30982103

SCHEMBL30982103

CC(=O)NCc1nccc(Cl)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
ALDH1A1 P00352 4/20 0.41
ELANE P08246 1/20 0.38
MAPT P10636 4/20 0.38
RAB9A P51151 3/20 0.38
POLB P06746 2/20 0.38
NOTUM Q6P988 1/20 0.38
ALOX15 P16050 1/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NPC1 O15118 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
SETDB1 Q15047 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL16397208 0.85 SMN1; SMN2 (0.35) L3MBTL1ALDH1A1RAB9APOLBKMT2A
SCHEMBL16410303 0.80 ATR (0.47) L3MBTL1RAB9APOLBKMT2AKDM4E
SCHEMBL30982180 0.78 MAPT (0.46) L3MBTL1ALDH1A1MAPTRAB9APOLB
SCHEMBL30982115 0.78 GPR35 (0.43) NPSR1L3MBTL1ALDH1A1MAPTRAB9A
SCHEMBL19127316 0.78 MTNR1A (0.57) NPSR1ELANEMTNR1AMTNR1B
SCHEMBL14590706 0.76 NPSR1 (0.52) NPSR1L3MBTL1ELANEMAPTRAB9A
SCHEMBL29215929 0.75 ALDH1A1 (0.44) ALDH1A1MAPTRAB9APOLBALOX15
SCHEMBL9250032 0.73 RECQL (0.53) NPSR1L3MBTL1ALDH1A1MAPTRAB9A
SCHEMBL30791573 0.73 RECQL (0.53) NPSR1L3MBTL1ALDH1A1MAPTRAB9A
SCHEMBL17117536 0.71 NPSR1 (0.77) NPSR1ALDH1A1MAPTRAB9APOLB

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-2024153595-A1 CHROMANE DERIVATIVES AS EGFR SELECTIVE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2024-07-25 WO disclosed