SCHEMBL2118153

SCHEMBL2118153

COc1ccc(-c2nc(O)cc(O)n2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.52
NPC1 O15118 6/20 0.52
RAB9A P51151 4/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
TP53 P04637 2/20 0.52
CLK4 Q9HAZ1 1/20 0.52
MAPK1 P28482 1/20 0.52
CASP3 P42574 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
SENP6 Q9GZR1 1/20 0.52
MAPT P10636 5/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ADORA3 P0DMS8 3/20 0.50
KDM4E B2RXH2 3/20 0.50
ADORA2B P29275 1/20 0.47
POLB P06746 2/20 0.46
ALDH1A1 P00352 1/20 0.46
PKM P14618 1/20 0.46

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
SCHEMBL9013541 0.89 ABCG2 (0.54) ESR2NPC1RAB9ASMN1; SMN2TP53
SCHEMBL9013519 0.85 KDM4E (0.55) SMN1; SMN2TP53MAPK1MAPTMEN1
SCHEMBL338452 0.83 CLK4 (0.64) ESR2NPC1RAB9ASMN1; SMN2TP53
SCHEMBL11247361 0.82 NPC1 (0.64) ESR2NPC1RAB9ASMN1; SMN2TP53
SCHEMBL15805573 0.82 ESR2 (0.72) ESR2NPC1RAB9ASMN1; SMN2TP53
SCHEMBL2876553 0.81 CLK4 (0.61) ESR2NPC1RAB9ASMN1; SMN2TP53
SCHEMBL15896952 0.81 CLK4 (0.61) ESR2NPC1RAB9ASMN1; SMN2TP53
SCHEMBL12888412 0.79 ADORA3 (0.54) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL6516972 0.78 NPC1 (0.66) ESR2NPC1RAB9ASMN1; SMN2TP53
SCHEMBL13658285 0.78 NPC1 (0.66) ESR2NPC1RAB9ASMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158787-B2 Process for producing trichloropyrimidine compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-04-17 US disclosed
US-20100160630-A1 PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
EP-2128141-A1 PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND Sumitomo Chemical Company, Limited (JP) 2009-12-02 EP disclosed
US-6372751-B1 DRUGS WITH BENZENE AND PYRIMIDINE RINGS BERLEX LABORATORIES, INC. 2002-04-16 US disclosed
EP-1135131-A4 ARYL AND HETEROCYCLYL SUBSTITUTED PYRIMIDINE DERIVATIVES AS ANTI-COAGULANTS BERLEX LAB (US) 2002-01-02 EP disclosed
EP-1135131-A1 ARYL AND HETEROCYCLYL SUBSTITUTED PYRIMIDINE DERIVATIVES AS ANTI-COAGULANTS BERLEX LABORATORIES, INC. (US) 2001-09-26 EP disclosed
US-6127376-A A BLOOD FACTOR XA ENZYME INHIBITOR TREATING A HUMAN HAVING A DISEASE-STATE CHARACTERIZED BY THROMBOTIC ACTIVITY BERLEX LABORATORIES, INC. (US) 2000-10-03 US disclosed
WO-2000033844-A1 ARYL AND HETEROCYCLYL SUBSTITUTED PYRIMIDINE DERIVATIVES AS ANTI-COAGULANTS BERLEX LATORATORIES, INC. (US) 2000-06-15 WO disclosed
CN-1233393-A Use of selective herbicidal compositions and method of treatment NITROKEMIA 2000 RT (HU) 1999-11-03 CN disclosed
EP-0055693-B1 USE OF PHENYL PYRIMIDINES AS PROTECTING AGENTS FOR CULTURE PLANTS AGAINST PHYTOTOXIC DAMAGE CAUSED BY HERBICIDES CIBA-GEIGY AG (CH) 1988-01-20 EP disclosed
US-4674229-A SEEDS COATED WITH PLANT SAFENING AGENT CIBA-GEIGY CORPORATION (US) 1987-06-23 US disclosed
EP-0136976-A2 Use of phenyl pyrimidines as plant regulators CIBA-GEIGY AG (CH) 1985-04-10 EP disclosed
US-4493726-A PLANT SAFENING AGENT CIBA GEIGY CORPORATION (US) 1985-01-15 US disclosed
EP-0055693-A1 Use of phenyl pyrimidines as protecting agents for culture plants against phytotoxic damage caused by herbicides CIBA-GEIGY AG (CH) 1982-07-07 EP 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-20100160630-A1 PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND DPYD, TYMP, TST ESR2 2601/4885NPC1 4790/4885RAB9A 2479/4885

“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.