SCHEMBL26326776

SCHEMBL26326776

CC(C)NCCC(O)c1c(F)cccc1F

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.47
HIF1A Q16665 2/20 0.47
KDM4E B2RXH2 1/20 0.39
ADRB2 P07550 5/20 0.38
ADRB1 P08588 5/20 0.38
ADRB3 P13945 4/20 0.38
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL24302602 0.82 TAAR1 (0.43) ADRB1ADRB3CES2CES1
SCHEMBL26326772 0.81 CYP2D6 (0.49) CYP2D6HIF1AKDM4EADRB2ADRB1
SCHEMBL24370608 0.77 CES2 (0.42) KDM4EADRB2CES2CES1
SCHEMBL26326775 0.77 CYP2D6 (0.43) CYP2D6HIF1AKDM4EADRB2ADRB1
SCHEMBL28410212 0.74 CES2 (0.42) CYP2D6ADRB1ADRB3CES2CES1
SCHEMBL26326758 0.73 ADRB1 (0.46) CYP2D6HIF1AKDM4EADRB2ADRB1
SCHEMBL30606520 0.73 CSNK1E (0.39) CES2CES1MEN1KMT2A
SCHEMBL12312535 0.73 CYP2D6 (0.54) CYP2D6HIF1AKDM4EADRB2ADRB1
SCHEMBL12312536 0.73 CYP2D6 (0.54) CYP2D6HIF1AKDM4EADRB2ADRB1
SCHEMBL10535014 0.73 CYP2D6 (0.54) CYP2D6HIF1AKDM4EADRB2ADRB1

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-11767322-B2 Triazolopyridinyl compounds as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2023-09-26 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-11767322-B2 Triazolopyridinyl compounds as kinase inhibitors RIPK1, RIPK3, RIPK4 CYP2D6 2658/4885HIF1A 3603/4885KDM4E 2044/4885

“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.