SCHEMBL1966099

SCHEMBL1966099

CCOC(=O)c1c(O)c2cccn2n(Cc2ccc(C(F)(F)F)cc2)c1=O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.44
ALDH1A1 P00352 7/20 0.44
ALOX5 P09917 2/20 0.43
RECQL P46063 1/20 0.42
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
HSP90AA1 P07900 1/20 0.41
CRHBP P24387 1/20 0.41
KMT2A Q03164 1/20 0.41
CRHR2 Q13324 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 1/20 0.39
FEN1 P39748 1/20 0.39

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
SCHEMBL3730844 0.90 KDM4E (0.45) KDM4EALDH1A1SMN1; SMN2HTT
SCHEMBL1966458 0.89 KDM4E (0.46) KDM4EALDH1A1RECQLMAPTMEN1
SCHEMBL1965910 0.89 ALDH1A1 (0.47) KDM4EALDH1A1ALOX5RECQLMAPT
SCHEMBL1967127 0.87 KDM4E (0.48) KDM4EALDH1A1ALOX5RECQLMAPT
SCHEMBL1967350 0.87 KDM4E (0.54) KDM4EALDH1A1RECQLMAPTMEN1
SCHEMBL1966096 0.85 FEN1 (0.53) KDM4EALDH1A1ALOX5RECQLMAPT
SCHEMBL1965742 0.83 KDM4E (0.47) KDM4EALDH1A1ALOX5RECQLMAPT
SCHEMBL1966103 0.82 KMT2A (0.50) KDM4EALDH1A1ALOX5RECQLMAPT
SCHEMBL1968371 0.82 KDM4E (0.47) KDM4EALDH1A1RECQLMEN1KMT2A
SCHEMBL1966018 0.82 LMNA (0.49) KDM4EALDH1A1ALOX5RECQLMAPT

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-2334682-B1 PYRROLO [ 1, 2 -B] PYRIDAZINE DERIVATIVES AND THEIR USE AS HIF MODULATORS FIBROGEN INC (US) 2017-10-04 EP disclosed
US-8217043-B2 Compounds and methods for their use FIBROGEN, INC. (US) 2012-07-10 US disclosed
EP-2334682-A1 PYRROLO [ 1, 2 -B] PYRIDAZINE DERIVATIVES AND THEIR USE AS HIF MODULATORS Fibrogen, Inc. (US) 2011-06-22 EP disclosed
WO-2010022240-A1 PYRROLO [ 1, 2 -B] PYRIDAZINE DERIVATIVES AND THEIR USE AS HIF MODULATORS FIBROGEN, INC. (US) 2010-02-25 WO disclosed
US-20100047367-A1 COMPOUNDS AND METHODS FOR THEIR USE FIBROGEN, INC. 2010-02-25 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-20100047367-A1 COMPOUNDS AND METHODS FOR THEIR USE HIF1AN, HIF1A, EGLN3 KDM4E 471/4885ALDH1A1 268/4885ALOX5 1766/4885

“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.