SCHEMBL23630642

SCHEMBL23630642

COc1cc(-c2ccc(Nc3ccc(CN(C)C)cc3)cc2)cc(F)c1F

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MELK Q14680 11/20 0.45
HRH3 Q9Y5N1 1/20 0.44
ACP1 P24666 1/20 0.41
TAAR1 Q96RJ0 1/20 0.40
CYP17A1 P05093 1/20 0.39
HTR7 P34969 1/20 0.38
TNKS O95271 1/20 0.38
MMP9 P14780 1/20 0.38

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
SCHEMBL31207324 1.00 MELK (0.45) MELKHRH3ACP1TAAR1CYP17A1
SCHEMBL23630646 0.87 HRH3 (0.46) MELKHRH3ACP1TAAR1CYP17A1
SCHEMBL31207322 0.87 HRH3 (0.46) MELKHRH3ACP1TAAR1CYP17A1
SCHEMBL23630637 0.80 HRH3 (0.47) MELKHRH3ACP1TAAR1HTR7
SCHEMBL31207326 0.80 HRH3 (0.47) MELKHRH3ACP1TAAR1HTR7
SCHEMBL23630647 0.78 ACP1 (0.47) MELKHRH3ACP1TAAR1
SCHEMBL31207320 0.78 ACP1 (0.47) MELKHRH3ACP1TAAR1
SCHEMBL21589940 0.74 ACP1 (0.47) MELKHRH3ACP1TAAR1
SCHEMBL23630643 0.72 MAOB (0.54) HRH3ACP1TAAR1
SCHEMBL29922075 0.72 MAOB (0.54) HRH3ACP1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3802492-B1 COMPOUNDS USEFUL IN THE TREATMENT OF DISORDERS ASSOCIATED WITH MUTANT RAS THE INSTITUTE OF CANCER RES ROYAL CANCER HOSPITAL (GB) 2024-11-06 EP claimed
US-11970469-B2 Compounds useful in the treatment of disorders associated with mutant RAS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2024-04-30 US claimed
US-20210214322-A1 COMPOUNDS USEFUL IN THE TREATMENT OF DISORDERS ASSOCIATED WITH MUTANT RAS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-07-15 US claimed
EP-3802492-B1 COMPOUNDS USEFUL IN THE TREATMENT OF DISORDERS ASSOCIATED WITH MUTANT RAS THE INSTITUTE OF CANCER RES ROYAL CANCER HOSPITAL (GB) 2024-11-06 EP disclosed
US-11970469-B2 Compounds useful in the treatment of disorders associated with mutant RAS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2024-04-30 US disclosed
US-20210214322-A1 COMPOUNDS USEFUL IN THE TREATMENT OF DISORDERS ASSOCIATED WITH MUTANT RAS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-07-15 US disclosed
US-20210214322-A1 COMPOUNDS USEFUL IN THE TREATMENT OF DISORDERS ASSOCIATED WITH MUTANT RAS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-07-15 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 (2 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-20210214322-A1 COMPOUNDS USEFUL IN THE TREATMENT OF DISORDERS ASSOCIATED WITH MUTANT RAS KRAS, NRAS, HRAS MELK 852/4885HRH3 3017/4885ACP1 729/4885
US-11970469-B2 Compounds useful in the treatment of disorders associated with mutant RAS KRAS, NRAS, HRAS MELK 852/4885HRH3 3017/4885ACP1 729/4885

“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.