SCHEMBL5478616

SCHEMBL5478616

CN(Cc1ccc(Cl)cc1)c1nc(-c2ccc(C(=O)N3CCCCC3)cc2)cn2ccnc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.45
▸ MAPT P10636 3/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ LSS P48449 2/20 0.44
▸ EPHB4 P54760 1/20 0.43
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ PARP1 P09874 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ SLC6A7 Q99884 1/20 0.39
▸ MKNK1 Q9BUB5 1/20 0.39
▸ MKNK2 Q9HBH9 1/20 0.39
▸ HSD11B1 P28845 1/20 0.38
▸ CHRNA7 P36544 1/20 0.38

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
SCHEMBL5483237 0.91 EPHB4 (0.45) HPGDRAB9ANPC1EPHB4KMT2A
SCHEMBL5479137 0.78 AURKA (0.59) HPGD
SCHEMBL1068623 0.76 HPGD (0.52) HPGDALDH1A1MAPTRAB9ANPC1
SCHEMBL5480118 0.76 EPHB4 (0.63) HPGDALDH1A1MAPTRAB9AEPHB4
SCHEMBL5478272 0.74 EPHB4 (0.58) MAPTEPHB4
SCHEMBL5482760 0.73 EPHB4 (0.70) EPHB4
SCHEMBL5478249 0.73 EPHB4 (0.61) HPGDALDH1A1MAPTRAB9AEPHB4
SCHEMBL5477405 0.72 EPHB4 (0.69) EPHB4
SCHEMBL5482855 0.71 EPHB4 (0.65) EPHB4
SCHEMBL5482755 0.71 EPHB4 (0.59) LSSEPHB4

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
US-7312341-B2 6-aryl-imidazo[1,2-a] pyrazin-8-ylamines, method of making, and method of use thereof CGI PHARMACEUTICALS, INC. (US) 2007-12-25 — — US claimed
US-20040067951-A1 6-aryl-imidazo[1,2-a] pyrazin-8-ylamines, method of making, and method of use thereof GILEAD CONNECTICUT, INC. 2004-04-08 — — US claimed
WO-2004022562-A1 6-ARYL-IMIDAZO[1,2-a]PYRAZIN-8-YLAMINES, METHOD OF MAKING, AND METHOD OF USE THEREOF CELLULAR GENOMICS, INC. (US) 2004-03-18 — — WO claimed
US-7312341-B2 6-aryl-imidazo[1,2-a] pyrazin-8-ylamines, method of making, and method of use thereof CGI PHARMACEUTICALS, INC. (US) 2007-12-25 — — US disclosed
US-20040067951-A1 6-aryl-imidazo[1,2-a] pyrazin-8-ylamines, method of making, and method of use thereof GILEAD CONNECTICUT, INC. 2004-04-08 — — US disclosed
WO-2004022562-A1 6-ARYL-IMIDAZO[1,2-a]PYRAZIN-8-YLAMINES, METHOD OF MAKING, AND METHOD OF USE THEREOF CELLULAR GENOMICS, INC. (US) 2004-03-18 — — 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-20040067951-A1 6-aryl-imidazo[1,2-a] pyrazin-8-ylamines, method of making, and method of use thereof MAP3K8, PRKACA, MAP3K1 HPGD 1671/4885ALDH1A1 1146/4885MAPT 1044/4885

“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.

Send feedback