SCHEMBL10029374

SCHEMBL10029374

O=C1OC(=O)C(c2ccccc2)(c2ccccc2)O1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.52
GOPC Q9HD26 1/20 0.52
CHRM2 P08172 2/20 0.40
CHRM4 P08173 2/20 0.40
GAA P10253 2/20 0.39
PKM P14618 1/20 0.39
HSP90AA1 P07900 2/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
LMNA P02545 2/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KMT2A Q03164 2/20 0.38
POLB P06746 1/20 0.38
ESR1 P03372 1/20 0.38
TP53 P04637 1/20 0.38
TYMS P04818 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL7635908 0.84 CFTR (0.56) CFTRGOPCCHRM2CHRM4GAA
SCHEMBL9304904 0.81 CFTR (0.54) CFTRGOPCCHRM2CHRM4GAA
SCHEMBL21922362 0.71 CHRM2 (0.45) CFTRGOPCCHRM2CHRM4GAA
SCHEMBL4567643 0.68 HCAR2 (0.39) LMNAMEN1ALDH1A1KMT2AMAPT
SCHEMBL3886398 0.68 CFTR (1.00) CFTRGOPCGAAPKMHSP90AA1
SCHEMBL11469864 0.67 CFTR (0.39) CFTRGOPCCHRM2CHRM4GAA
SCHEMBL10029373 0.65 ELANE (0.36) CFTRGOPCCHRM2LMNAALDH1A1
SCHEMBL28548234 0.65 HCAR2 (0.53) CFTRGOPCCHRM2CHRM4SMN1; SMN2
SCHEMBL12249757 0.65 CFTR (0.42) CFTRGOPCCHRM2CHRM4GAA
SCHEMBL11263455 0.65 PTGER3 (0.50) CFTRGOPCCHRM2CHRM4GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140343039-A1 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS ROBIN JEAN-PIERRE (CH) 2014-11-20 US disclosed
US-20140343039-A1 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS ROBIN JEAN-PIERRE (CH) 2014-11-20 US disclosed
US-20120022250-A1 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS ROBIN JEAN-PIERRE (CH) 2012-01-26 US disclosed
US-20120022250-A1 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS ROBIN JEAN-PIERRE (CH) 2012-01-26 US disclosed
WO-2010103405-A2 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS ROBIN JEAN-PIERRE (CH) 2010-09-16 WO 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 (2 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-20120022250-A1 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS CHRM1, OPRM1, CHRM2 CFTR 4639/4885GOPC 3496/4885CHRM2 3/4885
US-20140343039-A1 PROCESS FOR PREPARING CEPHALOTAXINE ESTERS CFH, C5, CHRM1 CFTR 4702/4885GOPC 2362/4885CHRM2 14/4885

“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.