SCHEMBL22374231

SCHEMBL22374231

CCNCCCCCC(C)(C)CC

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.50
CYP1A2 P05177 1/20 0.50
KDM1A O60341 5/20 0.46
MEN1 O00255 1/20 0.46
GLA P06280 1/20 0.46
KMT2A Q03164 1/20 0.46
TSHR P16473 2/20 0.44
SAT1 P21673 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HRH4 Q9H3N8 2/20 0.33
HRH3 Q9Y5N1 2/20 0.33
FFAR1 O14842 1/20 0.32
CPT2 P23786 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TP53 P04637 1/20 0.30

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
SCHEMBL22751206 0.98 CYP2C19 (0.52) CYP2C19CYP1A2KDM1AMEN1GLA
SCHEMBL27294760 0.91 CYP2C19 (0.50) CYP2C19CYP1A2KDM1AMEN1GLA
SCHEMBL21158602 0.84 TSHR (0.54) CYP2C19CYP1A2KDM1AMEN1GLA
SCHEMBL20207809 0.81 CYP2C19 (0.55) CYP2C19CYP1A2KDM1AMEN1GLA
SCHEMBL20804229 0.81 CA12 (0.52) CYP2C19CYP1A2MEN1KMT2ATSHR
SCHEMBL15926000 0.80 CYP2C19 (0.41) CYP2C19CYP1A2KDM1AMEN1GLA
SCHEMBL1834842 0.80 TDP1 (0.43) TSHRFFAR1CPT2TDP1
SCHEMBL1836223 0.80 TDP1 (0.43) TSHRFFAR1CPT2TDP1
SCHEMBL7863984 0.80 TDP1 (0.43) TSHRFFAR1CPT2TDP1
SCHEMBL19597731 0.79 EPHX1 (0.50) FFAR1CPT2TDP1

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-20200270207-A1 DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2020-08-27 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-20200270207-A1 DEOXYURIDINE TRIPHOSPHATASE INHIBITORS DUT, TYMP, DPYD CYP2C19 3154/4885CYP1A2 3141/4885KDM1A 1316/4885

“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.