SCHEMBL17738893

SCHEMBL17738893

OCCNc1cc(Cl)cc2[nH]ncc12

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 13/20 0.56
▸ TDO2 P48775 13/20 0.56
▸ METAP2 P50579 1/20 0.47
▸ BRAF P15056 1/20 0.39
▸ EIF2AK3 Q9NZJ5 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39

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
SCHEMBL17739262 0.84 TDO2 (0.52) IDO1TDO2METAP2BRAFEIF2AK3
SCHEMBL17739099 0.73 METAP2 (0.50) IDO1TDO2METAP2
SCHEMBL19249211 0.72 TDO2 (0.55) IDO1TDO2
SCHEMBL17738828 0.70 METAP2 (0.50) IDO1TDO2METAP2
SCHEMBL1060004 0.70 CYP2C19 (0.54) IDO1TDO2
SCHEMBL14487466 0.69 METAP2 (0.56) IDO1TDO2METAP2
SCHEMBL28673206 0.68 TDO2 (0.81) IDO1TDO2
SCHEMBL2905439 0.68 EGFR (0.41) IDO1TDO2
SCHEMBL470105 0.66 METAP2 (0.53) IDO1TDO2METAP2BRAFEIF2AK3
SCHEMBL2003535 0.66 METAP2 (0.53) IDO1TDO2METAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11130738-B2 Pharmaceutical compound IOMET PHARMA LTD. (GB) 2021-09-28 — — US disclosed
US-20200172492-A1 PHARMACEUTICAL COMPOUND IOMET PHARMA LTD. (GB) 2020-06-04 — — US disclosed
US-10590086-B2 Pharmaceutical compound IOMET PHARMA LTD. (GB) 2020-03-17 — — US disclosed
WO-2016071293-A2 PHARMACEUTICAL COMPOUND IOMET PHARMA LTD (GB) 2016-05-12 — — WO 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 (3 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-11130738-B2 Pharmaceutical compound IDO1, TDO2, IDO2 IDO1 1/4885TDO2 2/4885METAP2 840/4885
US-20200172492-A1 PHARMACEUTICAL COMPOUND IDO1, TDO2, IDO2 IDO1 1/4885TDO2 2/4885METAP2 840/4885
US-10590086-B2 Pharmaceutical compound IDO1, TDO2, IDO2 IDO1 1/4885TDO2 2/4885METAP2 840/4885

“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.

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