SCHEMBL3643545

SCHEMBL3643545

Fc1ccc(CNc2nc(N3CCCCC3)nc3cc(F)ccc23)cc1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 19/20 0.66
TCF7L2 Q9NQB0 19/20 0.66
HRH4 Q9H3N8 1/20 0.58

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
SCHEMBL3641690 0.88 CTNNB1 (0.76) CTNNB1TCF7L2HRH4
SCHEMBL3644755 0.87 HRH4 (0.55) CTNNB1TCF7L2HRH4
SCHEMBL3639927 0.87 CTNNB1 (0.76) CTNNB1TCF7L2HRH4
SCHEMBL3642983 0.86 CTNNB1 (0.68) CTNNB1TCF7L2HRH4
SCHEMBL29143528 0.85 CTNNB1 (0.59) CTNNB1TCF7L2HRH4
SCHEMBL3779862 0.85 EHMT2 (0.68) CTNNB1TCF7L2HRH4
Hydrochloric Acid SCHEMBL3637894 0.84 EHMT2 (0.67) CTNNB1TCF7L2HRH4
SCHEMBL3640774 0.81 APP (0.63) CTNNB1TCF7L2HRH4
SCHEMBL4179590 0.80 CTNNB1 (1.00) CTNNB1TCF7L2
SCHEMBL4178577 0.80 CTNNB1 (1.00) CTNNB1TCF7L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101784276-A Use of compounds for the preparation of antituberculosis agents SUMMIT CORP PLC 2010-07-21 CN claimed
US-20100317607-A1 USE OF COMPOUNDS FOR PREPARING ANTI-TUBERCULOSIS AGENTS INFECTIOUS DISEASE RESEARCH INSTITUTE (US) 2010-12-16 US disclosed
CN-101784276-A Use of compounds for the preparation of antituberculosis agents SUMMIT CORP PLC 2010-07-21 CN disclosed
EP-2173346-A2 USE OF COMPOUNDS FOR PREPARING ANTI-TUBERCULOSIS AGENTS Summit Corporation Plc (GB) 2010-04-14 EP disclosed
WO-2009001060-A2 USE OF COMPOUNDS FOR PREPARING ANTI-TUBERCULOSIS AGENTS SUMMIT CORPORATION PLC (GB) 2008-12-31 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 (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-20100317607-A1 USE OF COMPOUNDS FOR PREPARING ANTI-TUBERCULOSIS AGENTS TPX2, DCXR, RRM2 CTNNB1 4434/4885TCF7L2 1383/4885HRH4 360/4885

“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.