SCHEMBL18433062

SCHEMBL18433062

Fc1ccc(-n2cnnc2-c2ccncc2)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK10 P53779 2/20 0.59
▸ MAPK9 P45984 1/20 0.59
▸ OPRD1 P41143 3/20 0.40
▸ KDR P35968 1/20 0.38
▸ KCNH2 Q12809 2/20 0.37
▸ AOC3 Q16853 1/20 0.37
▸ CYP11B2 P19099 1/20 0.37
▸ BCHE P06276 1/20 0.37
▸ CYP17A1 P05093 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ OPRM1 P35372 1/20 0.36
▸ TUBB4A P04350 1/20 0.36
▸ TUBB P07437 1/20 0.36
▸ TUBA3C P0DPH7 1/20 0.36
▸ TUBA1B P68363 1/20 0.36
▸ TUBA4A P68366 1/20 0.36
▸ TUBB4B P68371 1/20 0.36
▸ TUBB3 Q13509 1/20 0.36
▸ TUBB2A Q13885 1/20 0.36
▸ TUBB8 Q3ZCM7 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
SCHEMBL13195961 0.74 MAPK10 (0.47) MAPK10MAPK9KDRKCNH2AOC3
SCHEMBL25215742 0.73 MAPK9 (0.52) MAPK10MAPK9OPRD1MAPK14MEN1
SCHEMBL15022265 0.73 MAPK9 (0.60) MAPK10MAPK9OPRD1OPRM1TUBB4A
SCHEMBL11086703 0.72 MAPK9 (0.68) MAPK10MAPK9OPRD1OPRM1MEN1
SCHEMBL15022063 0.70 MAPK10 (0.56) MAPK10MAPK9OPRD1OPRM1TUBB4A
SCHEMBL15709009 0.69 ALDH1A1 (0.64) MAPK10MAPK9LMNAKMT2AALDH1A1
SCHEMBL31278174 0.69 CYP3A4 (0.43) KCNH2CYP11B2CYP17A1CYP1A2MEN1
SCHEMBL23559029 0.69 CYP3A4 (0.43) KCNH2CYP11B2CYP17A1CYP1A2MEN1
SCHEMBL6279167 0.68 KDR (0.39) KDRBCHEMEN1LMNAMAPT
SCHEMBL18433027 0.68 MAPK9 (0.53) MAPK10MAPK9OPRD1TUBB4ATUBB

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-2694652-B1 MEDICAMENT FOR LIVER REGENERATION AND FOR TREATMENT OF LIVER FAILURE Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2017-02-01 — — EP disclosed
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