SCHEMBL31140487

SCHEMBL31140487

Cc1ncccc1-n1c(=O)[nH]c(=O)c2c(F)cc(Cl)cc21

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAT2A P31153 1/20 0.43
▸ KMO O15229 1/20 0.36
▸ P2RX7 Q99572 2/20 0.35
▸ DRD1 P21728 5/20 0.35
▸ MAPT P10636 2/20 0.34
▸ DOT1L Q8TEK3 1/20 0.34
▸ TP53 P04637 1/20 0.33
▸ PDE2A O00408 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ CDK4 P11802 1/20 0.33
▸ CCND1 P24385 1/20 0.33
▸ PARP1 P09874 1/20 0.33
▸ IDH1 O75874 1/20 0.32
▸ GRIN1 Q05586 1/20 0.32
▸ GRIN2B Q13224 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ HTT P42858 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
SCHEMBL31140485 1.00 MAT2A (0.43) MAT2AKMOP2RX7DRD1MAPT
SCHEMBL31140490 0.86 MAT2A (0.43) MAT2AP2RX7DRD1MAPTDOT1L
SCHEMBL31140492 0.86 MAT2A (0.43) MAT2AP2RX7DRD1MAPTDOT1L
SCHEMBL22093957 0.83 KDM4E (0.45) MAPTTP53KDM4EHTTSMN1; SMN2
SCHEMBL31145623 0.83 KDM4E (0.45) MAPTTP53KDM4EHTTSMN1; SMN2
SCHEMBL31140488 0.82 MAT2A (0.40) MAT2AP2RX7DRD1MAPTDOT1L
SCHEMBL31361093 0.81 MAT2A (0.39) MAT2AP2RX7DRD1MAPTDOT1L
SCHEMBL26487792 0.79 MAT2A (0.42) MAT2AP2RX7PDE2APDE10A
SCHEMBL31140483 0.76 MAT2A (0.35) MAT2ADOT1LPDE2A
SCHEMBL22094106 0.75 MEN1 (0.52) MAT2AKDM4E

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
CN-118900841-A Tricyclic compounds and uses thereof 石药集团中奇制药技术(石家庄)有限公司 2024-11-05 — — CN disclosed
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