SCHEMBL18405471

SCHEMBL18405471

CCc1cccc(C(C)=N)c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 2/20 0.50
▸ NOS3 P29474 1/20 0.48
▸ NOS2 P35228 1/20 0.48
▸ PRSS1 P07477 2/20 0.46
▸ PRSS2 P07478 2/20 0.46
▸ PRSS3 P35030 2/20 0.46
▸ LOXL2 Q9Y4K0 2/20 0.46
▸ KAT6A Q92794 2/20 0.45
▸ CNR2 P34972 1/20 0.45
▸ BCL2 P10415 1/20 0.43
▸ IDO1 P14902 1/20 0.42
▸ SMYD3 Q9H7B4 1/20 0.42
▸ TP53 P04637 1/20 0.41
▸ CYP4F2 P78329 2/20 0.40
▸ CYP4A11 Q02928 2/20 0.40
▸ TRPA1 O75762 1/20 0.39
▸ SIGMAR1 Q99720 2/20 0.39
▸ SLC7A5 Q01650 1/20 0.38

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
SCHEMBL16954571 0.83 BCL2 (0.46) PRSS1PRSS2PRSS3LOXL2KAT6A
SCHEMBL19527023 0.82 LOXL2 (0.69) NOS1NOS3NOS2PRSS1PRSS2
SCHEMBL1696803 0.82 PRSS1 (0.69) NOS1PRSS1PRSS2PRSS3LOXL2
SCHEMBL1363307 0.79 BCL2 (0.43) PRSS1PRSS2PRSS3LOXL2KAT6A
SCHEMBL334537 0.79 MAOB (0.53) LOXL2KAT6ACNR2BCL2SMYD3
SCHEMBL5956199 0.79 KAT6A (0.42) PRSS1PRSS2PRSS3LOXL2KAT6A
SCHEMBL16953885 0.78 CYP4F2 (0.42) PRSS1PRSS2PRSS3LOXL2KAT6A
SCHEMBL27892628 0.78 BCL2 (0.42) PRSS1PRSS2PRSS3LOXL2KAT6A
SCHEMBL7765712 0.78 BCL2 (0.50) LOXL2KAT6ACNR2BCL2SMYD3
Hydrochloric Acid SCHEMBL3131879 0.77 CYP4F2 (0.49) PRSS1PRSS2PRSS3LOXL2CNR2

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-3903583-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS III BASF SE (DE) 2021-11-03 — — EP disclosed
EP-3903582-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS II BASF SE (DE) 2021-11-03 — — EP disclosed
EP-2509602-B9 PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS CK2 INHIBITORS SENHWA BIOSCIENCES INC (TW) 2017-11-01 — — EP disclosed
EP-2509602-B1 PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS CK2 INHIBITORS SENHWA BIOSCIENCES INC (TW) 2017-01-25 — — EP disclosed
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