SCHEMBL31244769

SCHEMBL31244769

Cc1c(Cl)cnc2c1OCC1CNCCN21

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 20/20 0.44
HTR2A P28223 17/20 0.44
HTR2B P41595 16/20 0.44

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
SCHEMBL31244707 1.00 HTR2C (0.44) HTR2CHTR2AHTR2B
SCHEMBL31245250 0.89 HTR2A (0.47) HTR2CHTR2AHTR2B
SCHEMBL31245299 0.89 HTR2A (0.47) HTR2CHTR2AHTR2B
SCHEMBL31244628 0.89 HTR2A (0.47) HTR2CHTR2AHTR2B
SCHEMBL31244787 0.85 HTR2C (0.49) HTR2CHTR2AHTR2B
SCHEMBL31244708 0.85 HTR2C (0.49) HTR2CHTR2AHTR2B
SCHEMBL24640562 0.81 HTR2C (0.40) HTR2CHTR2AHTR2B
SCHEMBL31244776 0.76 HTR2A (0.51) HTR2CHTR2AHTR2B
SCHEMBL31245068 0.76 HTR2A (0.51) HTR2CHTR2AHTR2B
SCHEMBL31244755 0.76 HTR2C (0.43) HTR2CHTR2AHTR2B

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-20240336629-A1 Tricyclic Derivatives Useful As PARP7 Inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-10-10 US claimed

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-20240336629-A1 Tricyclic Derivatives Useful As PARP7 Inhibitors PARP1, PARP2, PARP11 HTR2C 1125/4885HTR2A 1918/4885HTR2B 726/4885

“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.