SCHEMBL1762822

SCHEMBL1762822

CCc1cccc(CC)c1-c1cc2ccn(Cc3cc(Cl)ccc3Cl)c2cn1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRPK2 P78362 1/20 0.38
SRPK1 Q96SB4 1/20 0.38
P2RX7 Q99572 1/20 0.37
KCNA3 P22001 3/20 0.37
DBH P09172 1/20 0.37
KDR P35968 3/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
FLT1 P17948 2/20 0.35
NR1I2 O75469 1/20 0.34
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
ADORA1 P30542 1/20 0.33
HTR1A P08908 1/20 0.33
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL1763191 0.91 KCNA3 (0.41) SRPK2SRPK1P2RX7KCNA3DBH
SCHEMBL1762715 0.87 DDR1 (0.37) SRPK2SRPK1P2RX7KDRFLT1
SCHEMBL1762851 0.81 HDAC3 (0.41) ADORA2A
SCHEMBL1762774 0.81 PKM (0.43)
SCHEMBL1762662 0.80 F2R (0.40) KDRFLT1
SCHEMBL1762595 0.79 TP53 (0.41) KDRFLT1
SCHEMBL1762705 0.79 LMNA (0.42) DBHADORA2AADORA1
SCHEMBL1762620 0.79 CYP11B1 (0.40) KDRFLT1
SCHEMBL1762935 0.78 HDAC8 (0.47)
SCHEMBL1762562 0.78 EPHX2 (0.43) P2RX7KDRFLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8633193-B2 Pyrrolo-pyridine, pyrrolo-pyrimidine and related heterocyclic compounds NOVARTIS AG (CH) 2014-01-21 US disclosed
US-20110118273-A1 PYRROLO-PYRIDINE, PYRROLO-PYRIMIDINE AND RELATED HETEROCYCLIC COMPOUNDS NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2011-05-19 US disclosed
US-7906528-B2 Such as 5-(2,6-diethyl-phenyl)-1H-pyrrolo[2,3-C]pyridine, which binds C5a receptors with high affinity; for treatment of inflammatory, cardiovascular, and immune system disorders; kits NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2011-03-15 US disclosed
US-20080267887-A1 Pyrrolo-Pyridine, Pyrrolo-Pyrimidine and Related Heterocyclic Compounds NEUROGEN CORPORATION (US) 2008-10-30 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 (2 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-20110118273-A1 PYRROLO-PYRIDINE, PYRROLO-PYRIMIDINE AND RELATED HETEROCYCLIC COMPOUNDS C5AR1, C5AR2, C3AR1 SRPK2 2735/4885SRPK1 3007/4885P2RX7 9/4885
US-20080267887-A1 Pyrrolo-Pyridine, Pyrrolo-Pyrimidine and Related Heterocyclic Compounds C5AR1, C5AR2, C3AR1 SRPK2 2735/4885SRPK1 3007/4885P2RX7 9/4885

“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.