SCHEMBL1968383

SCHEMBL1968383

C[C@H](NC(=O)c1c(O)c2cc(Cl)cn2n(Cc2ccccn2)c1=O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
HTT P42858 4/20 0.42
LMNA P02545 3/20 0.42
TSHR P16473 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
USP2 O75604 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
KDM4E B2RXH2 5/20 0.40
PKM P14618 1/20 0.40
KDM4C Q9H3R0 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
FEN1 P39748 1/20 0.37
EGLN1 Q9GZT9 5/20 0.37
BBOX1 O75936 2/20 0.37
FTO Q9C0B1 1/20 0.37
ADRA1D P25100 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36

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
SCHEMBL1968380 1.00 ALDH1A1 (0.42) ALDH1A1HTTLMNATSHRSMN1; SMN2
SCHEMBL1965863 0.85 EGLN1 (0.45) ALDH1A1HTTLMNATSHRSMN1; SMN2
SCHEMBL1968474 0.84 EGLN1 (0.42) ALDH1A1HTTKDM4EEGLN1PPARG
SCHEMBL1971151 0.84 EGLN1 (0.42) ALDH1A1HTTKDM4EEGLN1PPARG
SCHEMBL1968476 0.84 EGLN1 (0.42) ALDH1A1HTTKDM4EEGLN1PPARG
SCHEMBL1967836 0.84 P2RX3 (0.39) ALDH1A1HTTTSHRKDM4EKDM4C
SCHEMBL1967838 0.84 P2RX3 (0.39) ALDH1A1HTTTSHRKDM4EKDM4C
SCHEMBL1967481 0.83 GPR132 (0.43) ALDH1A1HTTLMNATSHRKDM4E
SCHEMBL1967484 0.83 GPR132 (0.43) ALDH1A1HTTLMNATSHRKDM4E
SCHEMBL1964900 0.83 HSP90B1 (0.46) ALDH1A1HTTLMNATSHRSMN1; SMN2

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 10 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 claimed
US-8217043-B2 Compounds and methods for their use FIBROGEN, INC. (US) 2012-07-10 US claimed
US-20100047367-A1 COMPOUNDS AND METHODS FOR THEIR USE FIBROGEN, INC. 2010-02-25 US claimed
EP-2334682-B1 PYRROLO [ 1, 2 -B] PYRIDAZINE DERIVATIVES AND THEIR USE AS HIF MODULATORS FIBROGEN INC (US) 2017-10-04 EP disclosed
CN-102264740-B Pyrrolo [ 1, 2 -b] pyridazine derivatives and their use as hif modulators FIBROGEN, INC. (US) 2014-10-15 CN disclosed
US-8217043-B2 Compounds and methods for their use FIBROGEN, INC. (US) 2012-07-10 US disclosed
CN-102264740-A Pyrrolo [ 1, 2 -b] pyridazine derivatives and their use as hif modulators 2011-11-30 CN 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 ALDH1A1 268/4885HTT 1833/4885LMNA 3079/4885

“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.