SCHEMBL4924658

SCHEMBL4924658

CCOC(=O)c1ncccc1C1=C(c2ccc(Cl)cc2OC)CCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.42
HRH1 P35367 3/20 0.41
CYP2C9 P11712 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 2/20 0.41
CYP2C19 P33261 2/20 0.41
CACNA1F O60840 1/20 0.41
NR1I2 O75469 1/20 0.41
GMNN O75496 1/20 0.41
USP2 O75604 1/20 0.41
ABCB11 O95342 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
CHRM2 P08172 1/20 0.41
ABCB1 P08183 1/20 0.41
CYP3A4 P08684 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
CYP2C8 P10632 1/20 0.41
CYP2D6 P10635 1/20 0.41

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
SCHEMBL4926630 0.93 CSF1R (0.43) CSF1RHRH1CYP2C9MEN1KMT2A
SCHEMBL4922991 0.85 GABRG2 (0.43) HRH1CYP2C9MEN1KMT2ANPC1
SCHEMBL4924653 0.81 BRD4 (0.42) CSF1RCYP2C9KMT2ACYP2C19LMNA
SCHEMBL5696865 0.79 PTGER1 (0.47) CYP2C9MEN1KMT2ANPC1CYP2C19
SCHEMBL4154581 0.78 PTGER1 (0.43) CYP2C9MEN1KMT2ALMNAGABRG2
SCHEMBL6141598 0.77 PDGFRB (0.42) CYP2C9MEN1KMT2ANPC1MAPT
SCHEMBL5696668 0.77 ALPL (0.42) CYP2C9MEN1KMT2ANPC1CYP2C19
SCHEMBL4914240 0.73 PTGER1 (0.51) CYP2C9MEN1KMT2ACYP2C19CYP3A4
SCHEMBL27492257 0.72 BRD4 (0.58) CYP2C9CYP2C19CYP3A4MAPTTSHR
SCHEMBL4154318 0.71 PTGER1 (0.42) CYP2C9MEN1KMT2ACYP2C19CYP3A4

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-20080234335-A1 Cyclohexene Compounds GLAXO GROUP LIMITED (GB) 2008-09-25 US disclosed
EP-1670764-A1 CYCLOHEXENE COMPOUNDS GLAXO GROUP LIMITED (GB) 2006-06-21 EP disclosed
WO-2005037794-A1 CYCLOHEXENE COMPOUNDS GLAXO GROUP LIMITED (GB) 2005-04-28 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-20080234335-A1 Cyclohexene Compounds C1R, CYP1B1, CYP2C9 CSF1R 2002/4885HRH1 16/4885CYP2C9 3/4885

“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.