SCHEMBL1716149

SCHEMBL1716149

CN1CC(O)Cc2c(NC(=O)Nc3ccc(Cl)cc3)cccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.46
KMT2A Q03164 7/20 0.46
NPC1 O15118 6/20 0.46
MEN1 O00255 6/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
RAB9A P51151 5/20 0.46
LMNA P02545 3/20 0.46
ALDH1A1 P00352 5/20 0.45
KDM4E B2RXH2 2/20 0.45
GLA P06280 1/20 0.45
GAA P10253 1/20 0.45
HTT P42858 2/20 0.43
P2RY1 P47900 1/20 0.43
TRPV1 Q8NER1 2/20 0.42
TP53 P04637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CNR1 P21554 2/20 0.40
NLRP1 Q9C000 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL1715545 0.83 TRPV1 (0.66) TRPV1
SCHEMBL1715593 0.81 MGLL (0.51) MAPTKMT2AMEN1KDM4EGAA
SCHEMBL1723394 0.81 NPC1 (0.50) MAPTKMT2ANPC1MEN1SMN1; SMN2
SCHEMBL12459925 0.79 GAA (0.40) MAPTKMT2AALDH1A1KDM4EGLA
SCHEMBL1715876 0.77 TRPV1 (0.52) MAPTKMT2ANPC1MEN1SMN1; SMN2
SCHEMBL1716188 0.76 CCR3 (0.37) MAPTP2RY1TRPV1
SCHEMBL4341397 0.75 TRPV1 (0.69) MAPTKMT2ANPC1MEN1SMN1; SMN2
SCHEMBL13613656 0.70 TRPV1 (0.62) MAPTKMT2ANPC1MEN1RAB9A
SCHEMBL1715687 0.66 ADRA2C (0.42) MAPTKMT2AMEN1SMN1; SMN2LMNA
SCHEMBL10713102 0.66 MEN1 (0.79) MAPTKMT2ANPC1MEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1685112-B1 TETRAHYDRO-QUINOLINYLUREA DERIVATIVES AS VR1 ANTAGONISTS BAYER SCHERING PHARMA AG (DE) 2011-07-20 EP claimed
JP-2007523888-A 2007-08-23 JP claimed
EP-1685112-A2 TETRAHYDRO-QUINOLINYLUREA DERIVATIVES Bayer HealthCare AG (DE) 2006-08-02 EP claimed
WO-2005044802-A2 TETRAHYDRO-QUINOLINYLUREA DERIVATIVES AS VRL ANTAGONISTS BAYER HEALTHCARE AG (DE) 2005-05-19 WO claimed
EP-1685112-B1 TETRAHYDRO-QUINOLINYLUREA DERIVATIVES AS VR1 ANTAGONISTS BAYER SCHERING PHARMA AG (DE) 2011-07-20 EP disclosed
US-20100137361-A1 Tetrahydro-Quinolinylurea Derivatives BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-06-03 US disclosed
US-7683076-B2 Tetrahydro-quinolinylurea derivatives BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-03-23 US disclosed
EP-1685112-A2 TETRAHYDRO-QUINOLINYLUREA DERIVATIVES Bayer HealthCare AG (DE) 2006-08-02 EP disclosed
WO-2005044802-A2 TETRAHYDRO-QUINOLINYLUREA DERIVATIVES AS VRL ANTAGONISTS BAYER HEALTHCARE AG (DE) 2005-05-19 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-20100137361-A1 Tetrahydro-Quinolinylurea Derivatives NMUR1, OPRL1, HVCN1 MAPT 2668/4885KMT2A 4264/4885NPC1 2064/4885

“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.