SCHEMBL31208350

SCHEMBL31208350

c1ccc2sc(-c3ccc(-c4cc(-c5ccc(-c6nc7ccccc7s6)cc5)nc(-c5ccc(-c6nc7ccccc7s6)cc5)n4)cc3)nc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 7/20 0.65
▸ RAB9A P51151 7/20 0.65
▸ KDM4E B2RXH2 5/20 0.65
▸ NPC1 O15118 5/20 0.65
▸ MAPT P10636 3/20 0.65
▸ ALDH1A1 P00352 3/20 0.65
▸ MMP9 P14780 2/20 0.65
▸ MMP8 P22894 2/20 0.65
▸ GLA P06280 2/20 0.65
▸ GAA P10253 2/20 0.65
▸ LMNA P02545 2/20 0.65
▸ MMP2 P08253 1/20 0.60
▸ MMP13 P45452 1/20 0.60
▸ MEN1 O00255 4/20 0.59
▸ KMT2A Q03164 4/20 0.59
▸ SMN1; SMN2 Q16637 3/20 0.59
▸ L3MBTL1 Q9Y468 2/20 0.59
▸ PKM P14618 1/20 0.59
▸ PAX8 Q06710 1/20 0.59
▸ NOD2 Q9HC29 1/20 0.59

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
SCHEMBL25260659 1.00 APP (0.65) APPRAB9AKDM4ENPC1MAPT
SCHEMBL24353063 0.97 RAB9A (0.61) APPRAB9AKDM4ENPC1MAPT
SCHEMBL25303434 0.95 RAB9A (0.59) APPRAB9AKDM4ENPC1MAPT
SCHEMBL31208337 0.95 RAB9A (0.59) APPRAB9AKDM4ENPC1MAPT
SCHEMBL25897450 0.95 RAB9A (0.59) APPRAB9AKDM4ENPC1MAPT
SCHEMBL25897016 0.95 RAB9A (0.59) APPRAB9AKDM4ENPC1MAPT
SCHEMBL25897019 0.90 RAB9A (0.54) APPRAB9AKDM4ENPC1MAPT
SCHEMBL25896875 0.90 RAB9A (0.54) APPRAB9AKDM4ENPC1MAPT
SCHEMBL9958225 0.89 RAB9A (0.56) APPRAB9AKDM4ENPC1MAPT
SCHEMBL25897248 0.89 APP (0.52) APPRAB9AKDM4ENPC1MAPT

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-4464702-A1 PYRIMIDINE COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2024-11-20 — — EP disclosed
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