SCHEMBL18328249

SCHEMBL18328249

Cn1nc(C(F)(F)F)c2c1CCCCCCCC2

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.56
TSHR P16473 3/20 0.56
NPSR1 Q6W5P4 1/20 0.56
GAA P10253 1/20 0.53
ALDH1A1 P00352 2/20 0.51
HTT P42858 1/20 0.51
GRIA2 P42262 5/20 0.47
CYP1A2 P05177 3/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2D6 P10635 2/20 0.47
KDM4E B2RXH2 1/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CYP2C19 P33261 1/20 0.45
MAPT P10636 3/20 0.44
POLQ O75417 1/20 0.44
SSTR4 P31391 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL15730538 1.00 LMNA (0.56) LMNATSHRNPSR1GAAALDH1A1
SCHEMBL14401055 0.98 LMNA (0.55) LMNATSHRNPSR1GAAALDH1A1
SCHEMBL15730331 0.94 LMNA (0.51) LMNATSHRNPSR1GAAALDH1A1
SCHEMBL15730334 0.85 SSTR4 (0.46) LMNATSHRNPSR1GAAALDH1A1
SCHEMBL15730113 0.84 SSTR4 (0.42) LMNATSHRNPSR1GAAALDH1A1
SCHEMBL19531701 0.81 SSTR4 (0.48) LMNATSHRNPSR1GAAALDH1A1
SCHEMBL15723804 0.79 LMNA (0.50) LMNATSHRNPSR1GAAALDH1A1
SCHEMBL20725338 0.79 LMNA (0.50) LMNATSHRNPSR1GAAALDH1A1
SCHEMBL23937912 0.78 LMNA (0.56) LMNATSHRNPSR1GAAALDH1A1
SCHEMBL20673843 0.78 SSTR4 (0.49) LMNATSHRNPSR1GAAALDH1A1

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-20160368881-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2016-12-22 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-20160368881-A1 THERAPEUTIC COMPOUNDS HAVCR2, SARS1, RPL35 LMNA 3258/4885TSHR 4700/4885NPSR1 3743/4885

“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.