SCHEMBL1969847

SCHEMBL1969847

CCOC(=O)c1cc2ccc(C(F)(F)F)cc2n1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.43
NOD2 Q9HC29 4/20 0.42
NOD1 Q9Y239 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
CCR2 P41597 1/20 0.41
MAPT P10636 3/20 0.41
KDM4E B2RXH2 3/20 0.41
CRHBP P24387 2/20 0.41
CRHR2 Q13324 2/20 0.41
HSP90AA1 P07900 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ALOX5 P09917 1/20 0.41
GRM5 P41594 1/20 0.41
PLA2G10 O15496 1/20 0.40
PLA2G2A P14555 1/20 0.40
PLA2G5 P39877 1/20 0.40
F10 P00742 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
SCHEMBL2139773 0.86 ALOX5 (0.46) MAOBNOD2NOD1MEN1KMT2A
SCHEMBL30995214 0.79 USP2 (0.43) MAOBNOD2NOD1MEN1KMT2A
SCHEMBL1585615 0.78 NOD2 (0.60) NOD2NOD1MEN1KMT2AMAPT
SCHEMBL6307714 0.76 CCR2 (0.74) NOD2NOD1CCR2MAPTKDM4E
SCHEMBL1965599 0.76 NOD2 (0.44) MAOBNOD2NOD1MEN1KMT2A
Hydrochloric Acid SCHEMBL29153651 0.75 KDM4E (0.49) NOD2NOD1MEN1KMT2ACCR2
SCHEMBL1968469 0.75 NOD2 (0.49) NOD2NOD1MEN1KMT2AMAPT
SCHEMBL17323081 0.74 MAPT (0.53) NOD2NOD1MEN1KMT2AMAPT
SCHEMBL31710561 0.73 MAPT (0.45) MAOBMEN1KMT2AMAPTKDM4E
SCHEMBL4504079 0.73 CACNA1B (0.45) MAOBMEN1KMT2AMAPTKDM4E

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 MAOB 766/4885NOD2 4164/4885NOD1 4514/4885

“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.