SCHEMBL20575355

SCHEMBL20575355

Fc1cc(F)c(N2C=C3CCCN3C2c2ccc3nccnc3c2)cc1F

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ECE2 P0DPD6 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK10 P53779 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.31

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
SCHEMBL20575615 0.93 HTT (0.31) KDM4EECE2GAAKMT2AALDH1A1
SCHEMBL20576426 0.90 ECE2 (0.31) ECE2HPGD
SCHEMBL20575217 0.88 HTT (0.30) HTT
SCHEMBL20576410 0.86 ECE2 (0.30) ECE2
SCHEMBL20575524 0.86 ECE2 (0.30) ECE2
SCHEMBL20575631 0.84 FLT3 (0.36) KDM4EECE2GAAKMT2AALDH1A1
SCHEMBL20575511 0.84 HPGD (0.32) KDM4EECE2GAAKMT2AHPGD
SCHEMBL20574809 0.84 HTR7 (0.32) ECE2
SCHEMBL20575156 0.84 HTR7 (0.32) ECE2
SCHEMBL20575604 0.84 PDE4B (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180346487-A1 Fused Imidazole Derivatives as TGF-Beta Inhibitors MIDCAP FINANCIAL TRUST 2018-12-06 US claimed

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-20180346487-A1 Fused Imidazole Derivatives as TGF-Beta Inhibitors TGFBR1, TGFBR2, SMAD3 KDM4E 798/4885ECE2 1479/4885GAA 1667/4885

“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.