SCHEMBL13764320

SCHEMBL13764320

Clc1ccc(-c2cn3ccnc(Cl)c3n2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.59
ALDH1A1 P00352 7/20 0.59
NPC1 O15118 7/20 0.59
KDM4E B2RXH2 4/20 0.59
PKM P14618 1/20 0.59
GAA P10253 2/20 0.56
HPGD P15428 2/20 0.56
GLA P06280 1/20 0.56
ALDH1A3 P47895 4/20 0.56
ALDH1A2 O94788 2/20 0.56
AURKA O14965 1/20 0.48
TMIGD3 P0DMS9 3/20 0.44
ADORA3 P0DMS8 2/20 0.44
MAPT P10636 2/20 0.44
TP53 P04637 4/20 0.43
NFKB1 P19838 2/20 0.43
NFKB2 Q00653 2/20 0.43
RELA Q04206 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
NPSR1 Q6W5P4 2/20 0.41

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
SCHEMBL3520105 0.89 RAB9A (0.55) RAB9AALDH1A1NPC1KDM4EPKM
SCHEMBL18189922 0.89 ALDH1A3 (0.58) RAB9AALDH1A1NPC1KDM4EPKM
SCHEMBL6648749 0.85 ALDH1A3 (0.46) RAB9AALDH1A1NPC1KDM4EPKM
SCHEMBL14164602 0.82 ALDH1A3 (0.46) RAB9AALDH1A1NPC1KDM4EPKM
SCHEMBL14164478 0.80 KDM4E (0.40) RAB9AALDH1A1NPC1KDM4EPKM
SCHEMBL14164482 0.80 RAB9A (0.44) RAB9AALDH1A1NPC1KDM4EPKM
SCHEMBL14164514 0.79 RAB9A (0.58) RAB9AALDH1A1NPC1KDM4EPKM
SCHEMBL13776789 0.78 EPHB4 (0.44) RAB9AALDH1A1NPC1KDM4EPKM
SCHEMBL19664874 0.76 RAB9A (0.51) RAB9AALDH1A1NPC1KDM4EPKM
SCHEMBL8240492 0.75 TMIGD3 (0.52) RAB9AALDH1A1NPC1KDM4EPKM

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
US-20090175852-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION 2009-07-09 US disclosed
US-7557104-B2 Imidazopyrazines as protein kinase inhibitors SCHERING CORPORATION (US) 2009-07-07 US disclosed
US-7557104-B2 Imidazopyrazines as protein kinase inhibitors SCHERING CORPORATION (US) 2009-07-07 US disclosed
US-20080027063-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION 2008-01-31 US disclosed
US-20080027063-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION 2008-01-31 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-20080027063-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS CHEK1, CHEK2, CDKN1A RAB9A 3242/4885ALDH1A1 3481/4885NPC1 3810/4885
US-20090175852-A1 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS CHEK1, CHEK2, CDKN1A RAB9A 3242/4885ALDH1A1 3481/4885NPC1 3810/4885

“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.