SCHEMBL5847718

SCHEMBL5847718

COC(=O)Cn1c(=O)c([N+](=O)[O-])cn(-c2ccccc2)c1=O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CMA1 P23946 2/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 6/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 5/20 0.39
POLB P06746 2/20 0.39
TP53 P04637 1/20 0.39
HSD17B10 Q99714 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL5848942 0.88 PDE4B (0.43) KDM4ESMN1; SMN2ALDH1A1KMT2AMAPT
SCHEMBL5847163 0.81 KMT2A (0.49) KDM4ESMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL6889608 0.76 CMA1 (0.38) SMN1; SMN2CMA1RAB9ANPC1ALDH1A1
SCHEMBL5847822 0.75 LPAR3 (0.43) SMN1; SMN2RAB9ANPC1ALDH1A1KMT2A
SCHEMBL28832049 0.73 KDM4E (0.59) KDM4ESMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL260808 0.69 KDM4E (0.50) KDM4ESMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL6980198 0.68 ELANE (0.55) KDM4ESMN1; SMN2RAB9AALDH1A1KMT2A
SCHEMBL7231594 0.68 ALDH1A1 (0.46) KDM4ESMN1; SMN2RAB9AALDH1A1KMT2A
SCHEMBL7366632 0.67 ADORA2B (0.43) KDM4ECMA1LMNAMAPTHTT
SCHEMBL7232479 0.67 TNF (0.46) KDM4ESMN1; SMN2RAB9AALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7015230-B1 Substituted polycyclic aryl and heteroaryl uracils useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION (US) 2006-03-21 US disclosed
US-20030023086-A1 Substituted polycyclic aryl and heteroaryl uracils useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2003-01-30 US disclosed
US-6458952-B1 ENZYME INHIBITORS FOR SERINE METHODS FOR PREVENTING AND TREATING THROMBOTIC CONDITIONS SUCH AS CORONARY ARTERY AND CEREBROVASCULAR DISEASE WITH COMPOUNDS THAT INHIBIT SERINE PROTEASES OF THE COAGULATION CASCADE. PHARMACIA CORPORATION 2002-10-01 US disclosed
EP-1178971-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL URACILS AS ANTICOAGULATIVE AGENTS Pharmacia Corporation (US) 2002-02-13 EP disclosed
WO-2001087852-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL URACILS USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE PHARMACIA CORPORATION (US) 2001-11-22 WO disclosed
WO-2000069833-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL URACILS AS ANTICOAGULATIVE AGENTS PHARMACIA CORPORATION (US) 2000-11-23 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-20030023086-A1 Substituted polycyclic aryl and heteroaryl uracils useful for selective inhibition of the coagulation cascade TFPI, PLAT, PLAU KDM4E 2451/4885SMN1; SMN2 3331/4885CMA1 281/4885

“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.