SCHEMBL14045908

SCHEMBL14045908

C=C(C)c1cc(P(=O)(c2cc(C(C)(C)C)c(OC)c(C(C)(C)C)c2)C(C)C(C)P(=O)(c2cc(C(=C)C)c(OC)c(C(C)(C)C)c2)c2cc(C(C)(C)C)c(OC)c(C(C)(C)C)c2)cc(C(C)(C)C)c1OC

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TNFRSF1A P19438 2/20 0.34
RARG P13631 1/20 0.33
RXRA P19793 1/20 0.33
PPARG P37231 1/20 0.33
PTGS2 P35354 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL12585362 1.00 TNFRSF1A (0.34) TNFRSF1ARARGRXRAPPARGPTGS2
SCHEMBL14615433 0.91 RARG (0.33) TNFRSF1ARARGRXRAPPARG
SCHEMBL14026094 0.86 PTGS2 (0.38) TNFRSF1APTGS2ALDH1A1TSHRTDP1
SCHEMBL470720 0.73 TNFRSF1A (0.33) TNFRSF1ARARGRXRAPPARG
SCHEMBL13705717 0.72 RXRA (0.50) TNFRSF1ARARGRXRAPPARGPTGS2
SCHEMBL8302162 0.71 TNFRSF1A (0.47) TNFRSF1ARARGRXRAPPARGPTGS2
SCHEMBL8308995 0.70 TNFRSF1A (0.43) TNFRSF1ARARGRXRAPPARGALDH1A1
SCHEMBL14045901 0.66 ALDH1A1 (0.33) TNFRSF1ARARGALDH1A1
SCHEMBL13889330 0.66 TNFRSF1A (0.37) TNFRSF1ARARGRXRAPPARGPTGS2
SCHEMBL13889244 0.66 TNFRSF1A (0.37) TNFRSF1ARARGRXRAPPARGPTGS2

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-20080242893-A1 Process for Preparing Optically Active Diphosphanes BASF AKTIENGESELLSCHAFT (DE) 2008-10-02 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-20080242893-A1 Process for Preparing Optically Active Diphosphanes PHOSPHO1, DCTPP1, DCPS TNFRSF1A 2955/4885RARG 1033/4885RXRA 2985/4885

“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.