SCHEMBL6619783

SCHEMBL6619783

Cc1ccc(C)n1-c1cccc(-c2ccc(C(C)C#N)cc2)n1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 1/20 0.36
KDM4E B2RXH2 3/20 0.35
LMNA P02545 1/20 0.35
IRAK4 Q9NWZ3 5/20 0.34
HSD11B1 P28845 2/20 0.34
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PIK3CD O00329 1/20 0.31
PDPK1 O15530 1/20 0.31
AKT1 P31749 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 1/20 0.31
USP30 Q70CQ3 2/20 0.31
POLB P06746 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL6620337 0.77 IRAK4 (0.41) KDM4ELMNAIRAK4ALDH1A1MAPT
SCHEMBL2969912 0.76 RAB9A (0.54) KDM4ELMNAALDH1A1MAPTPOLB
SCHEMBL6696955 0.75 RAB9A (0.42) KDM4ELMNAALDH1A1MAPTPIK3CA
SCHEMBL9848050 0.73 MAPT (0.47) KDM4ELMNAALDH1A1MAPTHPGD
SCHEMBL6618761 0.71 KDM4E (0.38) KDM4ELMNAHSD11B1ALDH1A1MAPT
SCHEMBL5877976 0.71 ALDH1A1 (0.42) KDM4ELMNAALDH1A1MAPTL3MBTL1
SCHEMBL6621303 0.70 KDM4E (0.50) KDM4EALDH1A1MAPTL3MBTL1POLB
SCHEMBL6701320 0.70 KDM4E (0.37) KDM4ELMNAHSD11B1ALDH1A1MAPT
SCHEMBL6619779 0.70 JAK1 (0.32) JAK1IRAK4HSD11B1ALDH1A1MAPT
SCHEMBL6700787 0.69 CYP2A6 (0.53) ALDH1A1

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
EP-0891332-B1 6-PHENYLPYRIDYL-2-AMINE DERIVATIVES PFIZER (US) 2004-03-17 EP disclosed
US-6465491-B2 NITRIC OXIDE SYNTHASE INHIBITOR; NERVOUS SYSTEM DISORDERS PFIZER INC. 2002-10-15 US disclosed
US-20010034348-A1 6-phenylpyridyl-2-amine derivatives LOWE JOHN A (US) 2001-10-25 US disclosed
US-6235747-B1 NITRIC OXIDE SYNTHASE INHIBITOR PFIZER INC. 2001-05-22 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-20010034348-A1 6-phenylpyridyl-2-amine derivatives NOS2, NOS3, NOS1 JAK1 1858/4885KDM4E 1317/4885LMNA 2447/4885

“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.