SCHEMBL28097358

SCHEMBL28097358

Nc1ccnc(COC=O)c1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.36
ASIC3 Q9UHC3 1/20 0.34
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL28987042 0.80 SRC (0.33) KDM4EALDH1A1SMN1; SMN2
SCHEMBL14680553 0.79 MAPT (0.35) KDM4EALDH1A1SMN1; SMN2
SCHEMBL25457192 0.79 KDM4E (0.38) KDM4EALDH1A1SMN1; SMN2
SCHEMBL7284124 0.79 SRC (0.41) SYKKDM4EALDH1A1SMN1; SMN2
SCHEMBL28065263 0.77 KDM4E (0.31) KDM4EALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL28293574 0.77 MAPT (0.34) KDM4EALDH1A1SMN1; SMN2
SCHEMBL7284511 0.76 NOS2 (0.54) SYKKDM4EALDH1A1
SCHEMBL17967618 0.76 NOS3 (0.38) SYKASIC3KDM4E
SCHEMBL7284095 0.75 MBOAT4 (0.38) SYKKDM4EALDH1A1SMN1; SMN2
SCHEMBL28051967 0.75 NOS3 (0.43) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114656401-A Method for preparing 4-chloropyridine-2-methyl formate serving as sorafenib key intermediate and suitable for industrial production 江苏恒沛药物科技有限公司 2022-06-24 CN disclosed
CN-103958521-B Pyrimidin-4-one derivatives and their use in the treatment, alleviation or prevention of viral diseases 弗·哈夫曼-拉罗切有限公司 2016-10-19 CN disclosed