SCHEMBL7573603

SCHEMBL7573603

Cn1c(-c2ccc(Cl)cc2)c(CCC(=O)O)c2cc(Cl)cnc21

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 16/20 0.62
TBXAS1 P24557 1/20 0.47
GPR17 Q13304 1/20 0.44
PLAU P00749 1/20 0.42

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
SCHEMBL7571685 0.88 TACR1 (0.57) TACR1
SCHEMBL6926561 0.81 TACR1 (0.65) TACR1TBXAS1
SCHEMBL7572338 0.78 TACR1 (1.00) TACR1
SCHEMBL8660161 0.73 TBXAS1 (0.50) TACR1TBXAS1GPR17
Hydrochloric Acid SCHEMBL7790354 0.72 TACR1 (0.64) TACR1TBXAS1
SCHEMBL7572603 0.71 MAP2 (0.46) TACR1GPR17
SCHEMBL6928199 0.71 TACR1 (0.65) TACR1TBXAS1
SCHEMBL7658708 0.69 TACR1 (0.58) TACR1TBXAS1
SCHEMBL4831256 0.69 ALDH1A1 (0.46)
SCHEMBL7790361 0.68 TACR1 (0.61) TACR1

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-20020022624-A1 Azaindole derivatives and their use as therapeutic agents MERCK SHARP & DOHME LTD. (GB) 2002-02-21 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-20020022624-A1 Azaindole derivatives and their use as therapeutic agents HTR2B, HNMT, HTR1B TACR1 1385/4885TBXAS1 787/4885GPR17 409/4885

“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.