SCHEMBL6618979

SCHEMBL6618979

COc1cc(CBr)ccc1-c1cccc(N2C(=O)c3ccccc3C2=O)n1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR1H3 Q13133 5/20 0.46
NR1H2 P55055 2/20 0.46
ALPL P05186 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GRM5 P41594 1/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
LMNA P02545 1/20 0.38
AR P10275 1/20 0.37

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
SCHEMBL6621911 0.83 MEN1 (0.45) NR1H3NR1H2ALPLMEN1KMT2A
SCHEMBL6623565 0.82 ALPL (0.39) NR1H3NR1H2ALPLGRM5ALDH1A1
SCHEMBL6618057 0.81 CYP2D6 (0.50) NR1H3NR1H2ALDH1A1TDP1KDM4E
SCHEMBL6676243 0.77 NR1H3 (0.57) NR1H3NR1H2MEN1KMT2AALDH1A1
SCHEMBL7221234 0.72 HTR7 (0.57)
SCHEMBL9395192 0.72 NR1H3 (0.47) NR1H3NR1H2ALPLMEN1KMT2A
SCHEMBL9937910 0.70 CA2 (0.48) ALDH1A1KDM4E
SCHEMBL68721 0.68 ALDH1A1 (0.45) NR1H3ALPLMEN1KMT2AALDH1A1
SCHEMBL31439009 0.68 KDM4E (0.57) NR1H3NR1H2ALPLMEN1KMT2A
SCHEMBL7229895 0.68 CYP1A1 (0.46) MEN1KMT2AALDH1A1MAPTTDP1

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 6 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
EP-0891332-A1 6-PHENYLPYRIDYL-2-AMINE DERIVATIVES PFIZER INC. (US) 1999-01-20 EP disclosed
WO-1997036871-A1 6-PHENYLPYRIDYL-2-AMINE DERIVATIVES PFIZER INC. (US) 1997-10-09 WO 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 NR1H3 895/4885NR1H2 740/4885ALPL 3138/4885

“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.