SCHEMBL3883601

SCHEMBL3883601

O=C(O)NCc1ccc(Cl)cc1F

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 1/20 0.54
ERCC4 Q92889 1/20 0.54
AKR1B1 P15121 3/20 0.52
P2RX7 Q99572 8/20 0.47
HTR2C P28335 1/20 0.47
HTR2B P41595 1/20 0.47
ALDH1A1 P00352 1/20 0.46
MMP2 P08253 1/20 0.45
ROCK2 O75116 2/20 0.44
ROCK1 Q13464 1/20 0.44
EPHX2 P34913 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
KLKB1 P03952 1/20 0.43
MAPK1 P28482 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
SCHEMBL7976991 0.85 CYP2C9 (0.54) ERCC1ERCC4AKR1B1P2RX7HTR2C
SCHEMBL7976988 0.85 ERCC1 (0.52) ERCC1ERCC4AKR1B1P2RX7HTR2C
SCHEMBL20446357 0.84 ERCC1 (0.51) ERCC1ERCC4AKR1B1ALDH1A1EPHX2
SCHEMBL23565573 0.83 ERCC1 (0.58) ERCC1ERCC4AKR1B1P2RX7HTR2C
SCHEMBL3460045 0.83 EPHX2 (0.54) ERCC1ERCC4AKR1B1ALDH1A1ROCK2
SCHEMBL3568253 0.82 P2RX7 (0.53) AKR1B1P2RX7ALDH1A1EPHX2NR1H4
SCHEMBL697972 0.82 ALDH1A1 (0.63) ERCC1ERCC4P2RX7ALDH1A1EPHX2
SCHEMBL13647246 0.82 ERCC1 (0.50) ERCC1ERCC4AKR1B1P2RX7HTR2C
SCHEMBL18887626 0.82 ERCC1 (0.50) ERCC1ERCC4P2RX7HTR2CHTR2B
SCHEMBL7934896 0.82 ERCC1 (0.57) ERCC1ERCC4AKR1B1P2RX7HTR2C

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
EP-2013163-A1 TETRASUBSTITUTED UREAS AS MODULATORS OF 11-BETA HYDROXYL STEROID DEHYDROGENASE TYPE 1 Incyte Corporation (US) 2009-01-14 EP disclosed
US-20070293529-A1 Tetrasubstituted ureas as modulators of 11-beta hydroxyl steroid dehydrogenase type 1 INCYTE CORPORATION 2007-12-20 US disclosed
WO-2007130898-A1 TETRASUBSTITUTED UREAS AS MODULATORS OF 11-β HYDROXYL STEROID DEHYDROGENASE TYPE 1 INCYTE CORPORATION (US) 2007-11-15 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 (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-20070293529-A1 Tetrasubstituted ureas as modulators of 11-beta hydroxyl steroid dehydrogenase type 1 HSD11B1, HSD17B1, HSD17B11 ERCC1 3109/4885ERCC4 3107/4885AKR1B1 101/4885

“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.