SCHEMBL18662802

SCHEMBL18662802

Cn1c(C(O)(c2ccccc2F)c2ccccc2F)nc2ccc(Br)cc21

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACSS2 Q9NR19 20/20 0.65

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
SCHEMBL18662854 0.86 ACSS2 (0.66) ACSS2
SCHEMBL17263100 0.81 ACSS2 (0.78) ACSS2
SCHEMBL20457044 0.81 ACSS2 (0.71) ACSS2
SCHEMBL17263133 0.80 ACSS2 (0.62) ACSS2
SCHEMBL17263021 0.80 ACSS2 (0.78) ACSS2
SCHEMBL17267146 0.79 ACSS2 (1.00) ACSS2
SCHEMBL24329947 0.78 ACSS2 (0.43) ACSS2
SCHEMBL17263142 0.77 ACSS2 (0.56) ACSS2
SCHEMBL18675060 0.76 ACSS2 (0.61) ACSS2
SCHEMBL15110814 0.76 MEN1 (0.44) ACSS2

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-10040767-B2 Benzimidazole derivatives and uses thereof PELOTON THERAPEUTICS, INC. (US) 2018-08-07 US disclosed
US-20170088523-A1 BENZIMIDAZOLE DERIVATIVES AND USES THEREOF PELOTON THERAPEUTICS, INC. 2017-03-30 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-20170088523-A1 BENZIMIDAZOLE DERIVATIVES AND USES THEREOF ACSS2, GLS2, ACSL3 ACSS2 1/4885
US-10040767-B2 Benzimidazole derivatives and uses thereof ACSS2, GLS2, ACSL3 ACSS2 1/4885

“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.