SCHEMBL17407526

SCHEMBL17407526

Cc1ccc(Oc2ccc(F)cc2C#N)cc1C=O

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 6/20 0.50
▸ SLC22A12 Q96S37 11/20 0.45
▸ HTR2A P28223 1/20 0.42
▸ SLC6A4 P31645 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ EPAS1 Q99814 1/20 0.40

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
SCHEMBL15994257 0.85 AR (0.47) ARSLC22A12KCNH2EPAS1
SCHEMBL11100867 0.80 AR (0.53) ARSLC22A12HTR2ASLC6A4KCNH2
SCHEMBL12216024 0.80 AR (0.50) ARSLC22A12HTR2ASLC6A4KCNH2
SCHEMBL5949965 0.78 AR (0.56) ARSLC22A12EPAS1
SCHEMBL378894 0.78 SLC22A12 (0.46) ARSLC22A12EPAS1
SCHEMBL378963 0.77 AR (0.50) ARSLC22A12HTR2ASLC6A4KCNH2
SCHEMBL14437173 0.76 AR (0.52) ARSLC22A12EPAS1
SCHEMBL2446602 0.75 MAPT (0.50) ARSLC22A12
SCHEMBL9889477 0.74 SLC22A12 (0.51) ARSLC22A12HTR2ASLC6A4KCNH2
SCHEMBL19057971 0.74 AR (0.47) ARSLC22A12KCNH2EPAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9790206-B2 Intermediates for use in the preparation of indazole derivatives and processes for the preparation thereof ARRAY BIOPHARMA INC. (US) 2017-10-17 — — US disclosed
US-20160002210-A1 INTERMEDIATES FOR USE IN THE PREPARATION OF INDAZOLE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF ARRAY BIOPHARMA INC. (US) 2016-01-07 — — 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-20160002210-A1 INTERMEDIATES FOR USE IN THE PREPARATION OF INDAZOLE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF CYP3A7, CYP3A5, CYP3A43 AR 3031/4885SLC22A12 3300/4885HTR2A 3937/4885

“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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