SCHEMBL2990872

SCHEMBL2990872

Cc1[c]c(C)c(-c2c(Cl)cccc2Cl)cc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.33
ALDH1A1 P00352 1/20 0.33
FGFR1 P11362 2/20 0.32
SRC P12931 2/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
LMNA P02545 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
SCHEMBL15637196 0.80 HSD11B1 (0.46) HSD11B1ALDH1A1CYP2A6LMNA
SCHEMBL3455954 0.79 MYC (0.37) ALDH1A1FGFR1CYP1A2CYP2A6
SCHEMBL8050739 0.76 GRIA1 (0.36) HSD11B1ALDH1A1SRCCYP1A2LMNA
SCHEMBL19534945 0.71 RAPGEF4 (0.31) CYP1A2CYP2A6
SCHEMBL1144540 0.71
SCHEMBL4371389 0.68 ESR2 (0.41) HSD11B1ALDH1A1CYP2A6LMNA
SCHEMBL1815221 0.67 FGFR1 (0.33) FGFR1SRCCYP1A2CYP2A6LMNA
SCHEMBL2990875 0.67 SRC (0.41) ALDH1A1FGFR1SRCCYP1A2CYP2A6
SCHEMBL8734269 0.67 ACHE (0.41) FGFR1
SCHEMBL11405867 0.67 PDK2 (0.34) ALDH1A1CYP1A2CYP2A6

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-20100197736-A1 CETP ACTIVITY INHIBITORS JAPAN TOBACCO INC. (JP) 2010-08-05 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-20100197736-A1 CETP ACTIVITY INHIBITORS CETP, MTTP, CES1 HSD11B1 51/4885ALDH1A1 3804/4885FGFR1 3629/4885

“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.