SCHEMBL13452328

SCHEMBL13452328

Cc1cccc(OCCCc2ccccc2)c1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.63
▸ DRD2 P14416 4/20 0.62
▸ DRD4 P21917 4/20 0.62
▸ KDM4E B2RXH2 2/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ HSD17B10 Q99714 2/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ MCL1 Q07820 1/20 0.53
▸ DRD3 P35462 3/20 0.53
▸ MAOA P21397 3/20 0.51
▸ MAOB P27338 3/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ RAB9A P51151 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL12015519 0.91 HPGD (0.60) HPGDDRD2DRD4KDM4EMAPK1
SCHEMBL13452127 0.85 F2 (0.61) HPGDDRD2DRD4KDM4EMAPK1
SCHEMBL20121675 0.85 MAOB (0.60) HPGDDRD2DRD4HSD17B10DRD3
SCHEMBL2063136 0.83 DRD2 (0.72) HPGDDRD2DRD4KDM4EMAPK1
SCHEMBL5686017 0.83 DRD2 (0.72) HPGDDRD2DRD4KDM4EMAPK1
SCHEMBL5176731 0.83 MAOB (0.52) HPGDDRD2DRD4KDM4EMAPK1
SCHEMBL11674802 0.83 DRD2 (0.66) DRD2DRD4KDM4EMAPK1HSD17B10
SCHEMBL4568912 0.83 KMT2A (0.53) DRD2DRD4KMT2ADRD3MAOA
SCHEMBL22336401 0.82 DRD2 (0.53) HPGDDRD2DRD4KDM4EMAPK1
SCHEMBL13645863 0.82 HSD17B10 (0.52) HPGDDRD2DRD4MAPK1HSD17B10

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
EP-1630165-B1 [1,2,4]TRIAZOLO[1,5-a]PYRIMIDIN-2-YLUREA DERIVATIVE AND USE THEREOF NIPPON KAYAKU KK (JP) 2010-03-31 — — EP disclosed
US-7598244-B2 [1,2,4]triazolo[1,5,a]pyrimidin-2-ylurea derivative and use thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-10-06 — — US disclosed
US-7598244-B2 [1,2,4]triazolo[1,5,a]pyrimidin-2-ylurea derivative and use thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-10-06 — — US disclosed
US-20070010515-A1 [1,2,4] Triazolo [1,5, a] pyrimidin-2-ylurea derivative and use thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2007-01-11 — — US disclosed
US-20070010515-A1 [1,2,4] Triazolo [1,5, a] pyrimidin-2-ylurea derivative and use thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2007-01-11 — — 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-20070010515-A1 [1,2,4] Triazolo [1,5, a] pyrimidin-2-ylurea derivative and use thereof HLA-C, TPMT, TAP1 HPGD 2052/4885DRD2 4227/4885DRD4 4612/4885

“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.

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