SCHEMBL4401024

SCHEMBL4401024

O=C(O)c1cccc(C(=O)CF)c1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALB P02768 1/20 0.57
ALDH1A1 P00352 5/20 0.52
KDM4E B2RXH2 4/20 0.52
HSD17B10 Q99714 3/20 0.52
HPGD P15428 2/20 0.52
MMP2 P08253 1/20 0.52
HMGB1 P09429 2/20 0.49
HNF4A P41235 1/20 0.48
ALOX15 P16050 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
NAPRT Q6XQN6 1/20 0.43
CA14 Q9ULX7 1/20 0.43
LMNA P02545 1/20 0.42

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
SCHEMBL1272896 0.83 ALDH1A1 (0.55) ALBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL110532 0.82 ALDH1A1 (0.70) ALBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL8436637 0.82 HNF4A (0.55) ALBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL3428071 0.81 ALDH1A1 (0.64) ALDH1A1KDM4EHSD17B10HPGDHMGB1
SCHEMBL1582462 0.81 HNF4A (0.63) ALBALDH1A1KDM4EHSD17B10HPGD
Methane SCHEMBL28154128 0.80 ALDH1A1 (0.67) ALBALDH1A1KDM4EHSD17B10HPGD
Hydrochloric Acid SCHEMBL28210457 0.80 ALDH1A1 (0.67) ALBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL28094410 0.80 ALDH1A1 (0.67) ALBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL7165288 0.80 ALDH1A1 (0.52) ALBALDH1A1KDM4EHSD17B10HPGD
SCHEMBL2763225 0.80 ALDH1A1 (0.57) ALBALDH1A1KDM4EHSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7572907-B2 Methods and compounds for polynucleotide synthesis AGILENT TECHNOLOGIES, INC. (US) 2009-08-11 US disclosed
EP-1717242-A1 Polynucleotide synthesis Agilent Technologies, Inc. (US) 2006-11-02 EP disclosed
US-20060247430-A1 Methods and compounds for polynucleotide synthesis AGILENT TECHNOLOGIES, INC. 2006-11-02 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-20060247430-A1 Methods and compounds for polynucleotide synthesis POLN, POLRMT, POLM ALB 3525/4885ALDH1A1 3888/4885KDM4E 4662/4885

“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.