SCHEMBL23138232

SCHEMBL23138232

CSCc1cnc2ccccc2c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.52
PDGFRB P09619 2/20 0.46
PDGFRA P16234 2/20 0.46
PDE10A Q9Y233 7/20 0.46
KDM1A O60341 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
MGAM O43451 1/20 0.42
ALDH1A1 P00352 2/20 0.41
RAB9A P51151 1/20 0.41
HTR3A P46098 1/20 0.41
CYP2A6 P11509 1/20 0.40

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
SCHEMBL10673413 0.85 CYP1A2 (0.50) CYP1A2PDGFRBPDGFRAPDE10AKDM1A
SCHEMBL272166 0.80 CYP1A2 (0.46) CYP1A2PDGFRBPDGFRAPDE10AKDM1A
SCHEMBL3820110 0.79 CYP1A2 (0.52) CYP1A2PDGFRBPDGFRAPDE10AKDM1A
SCHEMBL151560 0.79 CYP1A2 (0.57) CYP1A2PDGFRBPDGFRAPDE10AKDM1A
SCHEMBL5742532 0.79 MGAM (0.47) CYP1A2MGAMRAB9A
SCHEMBL3396692 0.79 CYP1A2 (0.55) CYP1A2PDGFRBPDGFRAPDE10AKDM1A
SCHEMBL28243569 0.78 CYP1A2 (0.50) CYP1A2PDGFRBPDGFRAPDE10AKDM1A
SCHEMBL6115113 0.76 TRPV1 (0.55) CYP1A2PDGFRBPDGFRAPDE10AKDM1A
SCHEMBL11179457 0.76 CYP1A2 (0.41) CYP1A2PDGFRBPDGFRAPDE10AKDM1A
SCHEMBL6597946 0.76 CYP1A2 (0.52) CYP1A2PDGFRBPDGFRAPDE10AKDM1A

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
US-20210087174-A1 ARYL AND HETEROARYL SUBSTITUTED INDOLE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-03-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210087174-A1 ARYL AND HETEROARYL SUBSTITUTED INDOLE COMPOUNDS TLR7, TLR1, TLR9 CYP1A2 1301/4885PDGFRB 243/4885PDGFRA 240/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.