SCHEMBL26112062

SCHEMBL26112062

CCOc1cc2nc[nH]c(=O)c2nc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.38
PARP1 P09874 4/20 0.38
ALDH1A1 P00352 2/20 0.38
ENPP1 P22413 1/20 0.37
RAB9A P51151 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GUSB P08236 1/20 0.36
PDPK1 O15530 1/20 0.35
CHEK1 O14757 1/20 0.35
PIM1 P11309 1/20 0.35
RPS6KA3 P51812 1/20 0.35
TRPV1 Q8NER1 1/20 0.34
PDE5A O76074 3/20 0.34
POLB P06746 1/20 0.34
ADORA3 P0DMS8 1/20 0.33
NPC1 O15118 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL31352773 1.00 SRC (0.38) SRCPARP1ALDH1A1ENPP1RAB9A
SCHEMBL30590825 0.85 SRC (0.52) SRCPARP1ALDH1A1RAB9AKDM4E
SCHEMBL26112587 0.85 SRC (0.52) SRCPARP1ALDH1A1RAB9AKDM4E
SCHEMBL30590827 0.81 PARP1 (0.36) SRCPARP1ALDH1A1PDPK1
SCHEMBL26112568 0.81 PARP1 (0.36) SRCPARP1ALDH1A1PDPK1
SCHEMBL30590804 0.77 PARP1 (0.45) PARP1ALDH1A1PDPK1CHEK1PIM1
SCHEMBL26112788 0.77 PARP1 (0.45) PARP1ALDH1A1PDPK1CHEK1PIM1
SCHEMBL1011012 0.74 PARP1 (0.50) SRCPARP1ALDH1A1ENPP1PDPK1
SCHEMBL26114200 0.74 ENPP1 (0.55) ALDH1A1ENPP1
SCHEMBL18655504 0.74 PARP1 (0.50) SRCPARP1ALDH1A1CHEK1PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4504719-A1 EGFR INHIBITORS Blueprint Medicines Corporation (US) 2025-02-12 EP disclosed
WO-2023196283-A1 EGFR INHIBITORS BLUEPRINT MEDICINES CORPORATION (US) 2023-10-12 WO disclosed
WO-2023196283-A1 EGFR INHIBITORS BLUEPRINT MEDICINES CORPORATION (US) 2023-10-12 WO disclosed