SCHEMBL18052987

SCHEMBL18052987

COc1cc(F)c2c(ccn2C(C)=O)c1F

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ NOTUM Q6P988 2/20 0.35
▸ GAA P10253 1/20 0.33
▸ FFAR4 Q5NUL3 1/20 0.32
▸ MTNR1A P48039 1/20 0.32
▸ MTNR1B P49286 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
SCHEMBL20224062 0.85 NOTUM (0.35) NOTUMMTNR1AMTNR1B
SCHEMBL18054178 0.83 PTGDR2 (0.35) MAPK1LMNAHTTRAB9A
SCHEMBL18054261 0.83 TNF (0.37) LMNAHTT
SCHEMBL20442993 0.82 NOTUM (0.31) NOTUM
SCHEMBL20227289 0.80 KDM4E (0.38) HTTFFAR4
SCHEMBL18054249 0.78 MAPK1 (0.34) MAPK1LMNAHTTRAB9AGAA
SCHEMBL16065337 0.76 RHEB (0.37) MAPK1LMNAHTTRAB9A
SCHEMBL18054260 0.76 NOTUM (0.50) MAPK1LMNAHTTRAB9ANOTUM
SCHEMBL20977771 0.74 BRPF1 (0.33) LMNARAB9A
SCHEMBL20224091 0.74 ACLY (0.35) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3261637-B1 PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS AND THEIR THERAPEUTICAL APPLICATIONS NANTBIOSCIENCE INC (US) 2021-05-26 — — EP disclosed
EP-3261638-B1 PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS AND THEIR THERAPEUTICAL APPLICATIONS NANTBIOSCIENCE INC (US) 2019-05-08 — — EP disclosed
WO-2016138527-A1 PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS AND THEIR THERAPEUTICAL APPLICATIONS NANTBIOSCIENCE, INC. (US) 2016-09-01 — — WO disclosed
WO-2016137506-A1 PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS AND THEIR THERAPEUTICAL APPLICATIONS NANTBIOSCIENCE, INC. (US) 2016-09-01 — — WO disclosed
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