SCHEMBL9550604

SCHEMBL9550604

CC1C=C(C(C)(C)C)c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.34
HTR2A P28223 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
SCHEMBL3192378 0.79 GPR3 (0.31) GPR3
SCHEMBL5702797 0.78 GPR3 (0.33) GPR3
SCHEMBL29732984 0.78 KMT2A (0.33) GPR3
SCHEMBL7863731 0.78 GPR3 (0.38) GPR3HTR2A
SCHEMBL5473851 0.78 GPR3 (0.33) GPR3
SCHEMBL7632502 0.77 GPR3 (0.31) GPR3
SCHEMBL6401816 0.76 HTR6 (0.33) GPR3HTR2A
Hydrochloric Acid SCHEMBL7609107 0.76 GPR3 (0.36) GPR3
Hydrochloric Acid SCHEMBL3192369 0.76 GPR3 (0.32) GPR3
Hydrochloric Acid SCHEMBL28436054 0.76 GPR3 (0.32) GPR3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5208987-A None JP disclosed
US-20230106731-A1 INHIBITORS OF MUTANT FAMILY TYROSINE-KINASES SPECTRUM PHARMACEUTICALS, INC. (US) 2023-04-06 US disclosed
JP-H05208987-A HAFNIUM COMPOUND HAVING ASYMMETRIC LIGAND AND CATALYST COMPONENT SHOWA DENKO KK 1993-08-20 JP 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-20230106731-A1 INHIBITORS OF MUTANT FAMILY TYROSINE-KINASES ERBB2, EGFR, ERBB3 GPR3 1639/4885HTR2A 2589/4885

“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.