SCHEMBL1976397

SCHEMBL1976397

CCCCn1c(=O)c(C(=O)NC(NC(=O)c2c(O)c3cccn3n(CCCC)c2=O)C(=O)O)c(O)c2cccn21

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
MEN1 O00255 9/20 0.46
KMT2A Q03164 9/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 3/20 0.42
HTT P42858 2/20 0.42
NPC1 O15118 1/20 0.41
HTR3E A5X5Y0 1/20 0.41
HTR3B O95264 1/20 0.41
HTR3A P46098 1/20 0.41
HTR3D Q70Z44 1/20 0.41
HTR3C Q8WXA8 1/20 0.41
HPGD P15428 2/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 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
SCHEMBL1980308 0.96 TDP1 (0.50) POLBTDP1MEN1KMT2ASMN1; SMN2
SCHEMBL1987167 0.82 EGLN1 (0.42) MEN1KMT2ASMN1; SMN2KDM4EALDH1A1
SCHEMBL1967538 0.77 KDM4E (0.63) POLBMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL1965306 0.73 ALDH1A1 (0.64) POLBMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL1970302 0.70 KDM4E (0.42) SMN1; SMN2KDM4EALDH1A1HTT
SCHEMBL1966102 0.69 KDM4E (0.43) MEN1KMT2ASMN1; SMN2KDM4EALDH1A1
SCHEMBL1966106 0.69 KDM4E (0.43) MEN1KMT2ASMN1; SMN2KDM4EALDH1A1
SCHEMBL3761069 0.67 ALDH1A1 (0.51) POLBMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL1968949 0.65 EGLN1 (0.61) MEN1KMT2ANPC1
SCHEMBL1965787 0.63 EGLN1 (0.53) MEN1KMT2A

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 POLB 857/4885TDP1 3390/4885MEN1 3904/4885

“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.