SCHEMBL27779502

SCHEMBL27779502

Oc1ccccc1-c1cncc(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.47
ALDH1A1 P00352 1/20 0.47
BCL2L1 Q07817 1/20 0.47
HSD17B10 Q99714 1/20 0.47
KDM1A O60341 2/20 0.46
HDAC1 Q13547 2/20 0.46
HDAC6 Q9UBN7 1/20 0.46
MKNK1 Q9BUB5 1/20 0.44
MKNK2 Q9HBH9 1/20 0.44
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
IDO1 P14902 4/20 0.42
QPCT Q16769 1/20 0.41
QPCTL Q9NXS2 1/20 0.41
ESR2 Q92731 1/20 0.41
FGFR1 P11362 1/20 0.39
MGAM O43451 1/20 0.39
PRKAB2 O43741 1/20 0.39

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
SCHEMBL7232205 0.81 METAP2 (0.49) ALDH1A1MKNK1MKNK2FGFR1MAPT
SCHEMBL5687618 0.79 MKNK1 (0.45) ALDH1A1MKNK1MKNK2IDO1ESR2
SCHEMBL4446246 0.78 CYP2A6 (0.47) HPGDALDH1A1BCL2L1HSD17B10KDM1A
SCHEMBL27783776 0.78 KDM1A (0.49) HPGDALDH1A1BCL2L1HSD17B10KDM1A
SCHEMBL8446312 0.76 MKNK1 (0.46) MKNK1MKNK2
SCHEMBL29434894 0.75 ALDH1A1 (0.58) HPGDALDH1A1BCL2L1HSD17B10NPC1
SCHEMBL7110132 0.75 ALDH1A1 (0.58) HPGDALDH1A1BCL2L1HSD17B10NPC1
SCHEMBL5700123 0.74 MKNK1 (0.55) ALDH1A1MKNK1MKNK2FGFR1NPSR1
SCHEMBL28988268 0.74 ALDH1A1 (0.50) HPGDALDH1A1BCL2L1HSD17B10KMT2A
SCHEMBL10356483 0.74 ALDH1A1 (0.56) HPGDALDH1A1BCL2L1HSD17B10KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110177786-A Pyrazolo [1,5-A] pyridine compounds being substituted are as RET kinase inhibitor 阿雷生物药品公司 2019-08-27 CN disclosed
CN-101553233-B Kinase inhibitors useful for the treatment of myleoproliferative diseases and other proliferative diseases DECIPHERA PHARMACEUTICALS LLC 2013-05-29 CN disclosed
CN-101553233-A Kinase inhibitors useful for the treatment of myleoproliferative diseases and other proliferative diseases DECIPHERA PHARMACEUTICALS LLC (US) 2009-10-07 CN disclosed