SCHEMBL6166003

SCHEMBL6166003

COC(=O)c1ccc2c(c1)CCN(C(=O)C(Cc1c[nH]c3ccccc13)NC(=O)C(C)(C)N)C2

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 6/20 0.49
OPRM1 P35372 1/20 0.49
PKM P14618 1/20 0.46
ITGB2 P05107 1/20 0.46
ICAM1 P05362 1/20 0.46
ITGAL P20701 1/20 0.46
GPR84 Q9NQS5 1/20 0.45
ERAP2 Q6P179 1/20 0.45
ACE P12821 1/20 0.45
F10 P00742 1/20 0.45
UGCG Q16739 2/20 0.44
HCRTR2 O43614 2/20 0.44
CYP3A4 P08684 1/20 0.44
P2RY12 Q9H244 1/20 0.44
MEN1 O00255 1/20 0.43
HCRTR1 O43613 1/20 0.43
KMT2A Q03164 1/20 0.43

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
Hydrochloric Acid SCHEMBL6165999 0.99 GHSR (0.48) GHSROPRM1PKMITGB2ICAM1
Hydrochloric Acid SCHEMBL6166005 0.99 GHSR (0.48) GHSROPRM1PKMITGB2ICAM1
Hydrochloric Acid SCHEMBL6160499 0.92 GHSR (0.49) GHSROPRM1PKMITGB2ICAM1
Hydrochloric Acid SCHEMBL6160507 0.92 GHSR (0.49) GHSROPRM1PKMITGB2ICAM1
Hydrochloric Acid SCHEMBL6161493 0.89 ITGB2 (0.48) GHSROPRM1ITGB2ICAM1ITGAL
Hydrochloric Acid SCHEMBL6161499 0.89 ITGB2 (0.48) GHSROPRM1ITGB2ICAM1ITGAL
SCHEMBL6162193 0.89 MEN1 (0.45) PKMITGB2ICAM1ITGALACE
SCHEMBL6162200 0.89 MEN1 (0.45) PKMITGB2ICAM1ITGALACE
Hydrochloric Acid SCHEMBL6163089 0.89 ITGB2 (0.47) GHSROPRM1ITGB2ICAM1ITGAL
Hydrochloric Acid SCHEMBL6163083 0.89 ITGB2 (0.47) GHSROPRM1ITGB2ICAM1ITGAL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 EP claimed
EP-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 EP disclosed