SCHEMBL29637752

SCHEMBL29637752

CCc1nc(C)c(C(N)=O)o1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DDR1 Q08345 1/20 0.40
GAA P10253 1/20 0.36
DGAT1 O75907 2/20 0.35
POLB P06746 1/20 0.34
PARP1 P09874 1/20 0.33
HTT P42858 1/20 0.32
NTRK1 P04629 1/20 0.32
PRKCB P05771 1/20 0.31
KMT2A Q03164 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
ELANE P08246 1/20 0.30

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
Hydrochloric Acid SCHEMBL5008312 0.98 DDR1 (0.39) DDR1GAADGAT1POLBPARP1
SCHEMBL20577192 0.85 POLB (0.34) POLBHTTKDM4EALDH1A1
SCHEMBL597035 0.84 DDR1 (0.41) DDR1GAADGAT1NTRK1PRKCB
Hydrochloric Acid SCHEMBL3822769 0.83 POLB (0.33) POLBHTT
Hydrochloric Acid SCHEMBL3820275 0.83 POLB (0.33) POLBHTT
SCHEMBL8616898 0.82 DDR1 (0.40) DDR1GAADGAT1NTRK1PRKCB
SCHEMBL3826604 0.80 LMNA (0.36) DDR1POLBHTTKMT2AKDM4E
SCHEMBL5008313 0.80 MEN1 (0.37) GAAPOLBHTTKMT2AKDM4E
SCHEMBL3828653 0.78 ELANE (0.43) POLBHTTKMT2AKDM4EALDH1A1
SCHEMBL3828999 0.76 NPSR1 (0.31) DDR1KDM4EALDH1A1

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-20220202815-A1 TREATMENT OF CANCER MINGSIGHT PHARMACEUTICALS, INC. 2022-06-30 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-20220202815-A1 TREATMENT OF CANCER PRKACB, PRKDC, PRKCH DDR1 1505/4885GAA 3378/4885DGAT1 2586/4885

“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.