SCHEMBL13167693

SCHEMBL13167693

Cc1nc(OCc2ccccc2)cc(=O)n1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.49
TSHR P16473 1/20 0.43
NUDT1 P36639 1/20 0.43
GRM5 P41594 4/20 0.43
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HRH4 Q9H3N8 1/20 0.41
MCHR1 Q99705 1/20 0.41
LMNA P02545 1/20 0.40
RECQL P46063 1/20 0.40
POLB P06746 1/20 0.40
GPR84 Q9NQS5 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
SCHEMBL3522364 0.83 MAPK14 (0.54) PKMNPC1RAB9AL3MBTL1SMN1; SMN2
SCHEMBL3526368 0.81 PKM (0.49) PKMNPC1RAB9AL3MBTL1SMN1; SMN2
SCHEMBL13167692 0.75 L3MBTL1 (0.52) PKMNPC1RAB9AL3MBTL1SMN1; SMN2
SCHEMBL3526542 0.72 GRM5 (0.60) GRM5LMNA
SCHEMBL9383008 0.71 TSHR (0.51) SMN1; SMN2TSHRGRM5HSD17B10ALDH1A1
SCHEMBL10440196 0.70 GRM5 (0.77) PKMSMN1; SMN2GRM5ALDH1A1MCHR1
SCHEMBL27122945 0.69 GRM5 (0.43) PKMTSHRNUDT1GRM5ALDH1A1
SCHEMBL603696 0.69 NUDT1 (0.48) PKML3MBTL1SMN1; SMN2TSHRNUDT1
SCHEMBL3524283 0.69 PKM (0.51) PKMNPC1RAB9ASMN1; SMN2TSHR
SCHEMBL12157689 0.68 ALDH1A1 (0.51) PKML3MBTL1SMN1; SMN2TSHRNUDT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7795271-B2 Substituted pyrimidinones PHARMACIA CORPORATION (US) 2010-09-14 US disclosed
US-20090306108-A1 SUBSTITUTED PYRIMIDINONES PFIZER INC 2009-12-10 US disclosed
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES PHARMACIA CORPORATION (US) 2007-07-19 US disclosed
US-7183287-B2 Substituted pyrimidinones PHARMACIA CORPORATION (US) 2007-02-27 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 (2 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-20090306108-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 PKM 994/4885NPC1 2314/4885RAB9A 682/4885
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 PKM 994/4885NPC1 2314/4885RAB9A 682/4885

“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.