SCHEMBL26200718

SCHEMBL26200718

CSc1ccc(CC(C)c2ccncc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 17/20 0.53
MAOA P21397 1/20 0.53
SLC6A2 P23975 1/20 0.53
SLC6A3 Q01959 1/20 0.53
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46

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
SCHEMBL151540 0.83 ESR1 (0.52) SLC6A4MAOASLC6A2SLC6A3ESR1
SCHEMBL19734040 0.80 ESR1 (0.55) SLC6A4SLC6A2SLC6A3ESR1ESR2
SCHEMBL4441903 0.79 ESR1 (0.48) SLC6A4SLC6A2SLC6A3ESR1ESR2
Bromide SCHEMBL11693475 0.77 SLC6A2 (0.63) SLC6A4MAOASLC6A2SLC6A3ESR1
SCHEMBL6888087 0.74 SLC6A4 (0.60) SLC6A4MAOASLC6A2SLC6A3ESR1
SCHEMBL8361629 0.74 LOXL2 (0.46) SLC6A4MAOASLC6A2SLC6A3
SCHEMBL8119219 0.73 SLC6A4 (0.69) SLC6A4MAOASLC6A2SLC6A3
SCHEMBL4437809 0.72 POLB (0.58) ESR1ESR2
SCHEMBL4441899 0.71 ESR1 (0.48) SLC6A4SLC6A2SLC6A3ESR1ESR2
SCHEMBL14269722 0.70 PABPC1 (0.46) SLC6A4MAOASLC6A2SLC6A3ESR1

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-20230271968-A1 PYRAZOLOPYRIMIDINE COMPOUND USED AS ATR KINASE INHIBITOR BEIJING TIDE PHARMACEUTICAL CO., LTD. (CN) 2023-08-31 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-20230271968-A1 PYRAZOLOPYRIMIDINE COMPOUND USED AS ATR KINASE INHIBITOR ATR, CHEK1, CHEK2 SLC6A4 4734/4885MAOA 3114/4885SLC6A2 4784/4885

“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.