SCHEMBL19675161

SCHEMBL19675161

NN1Cc2ccc(F)cc2C1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP9 Q86TI2 11/20 0.47
DPP8 Q6V1X1 8/20 0.47
DPP4 P27487 8/20 0.47
DPP7 Q9UHL4 5/20 0.47
KCNH2 Q12809 3/20 0.44
TMEM97 Q5BJF2 3/20 0.44
SIGMAR1 Q99720 3/20 0.44
PITRM1 Q5JRX3 1/20 0.41
ADORA2A P29274 1/20 0.39
HSP90B1 P14625 2/20 0.39
TRAP1 Q12931 2/20 0.39
FAP Q12884 1/20 0.35
KDM1A O60341 1/20 0.35

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
SCHEMBL13068138 0.84 KMT2A (0.41) DPP9DPP8DPP4DPP7KCNH2
SCHEMBL13068164 0.84 KMT2A (0.41) DPP9DPP8DPP4DPP7KCNH2
SCHEMBL10209346 0.77 DPP9 (0.46) DPP9DPP8DPP4DPP7KCNH2
SCHEMBL8228638 0.77 DPP9 (0.47) DPP9DPP8DPP4DPP7KCNH2
SCHEMBL14223471 0.74 PDK2 (0.42)
SCHEMBL30142417 0.74 DPP9 (0.63) DPP9DPP8DPP4DPP7PITRM1
SCHEMBL11434101 0.73 HTR2A (0.42) DPP4KCNH2TMEM97SIGMAR1FAP
SCHEMBL19700136 0.72 KCNH2 (0.59) DPP9DPP8DPP4DPP7KCNH2
SCHEMBL14163034 0.72 KCNH2 (0.47) DPP9DPP8DPP4DPP7KCNH2
SCHEMBL10057635 0.72 KCNH2 (0.59) DPP9DPP8DPP4DPP7KCNH2

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-3746443-B1 TRIAZOLOPYRIMIDINE DERIVATIVES FOR USE AS GHRELIN O-ACYL TRANSFERASE (GOAT) INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2022-07-06 EP disclosed
WO-2019149660-A1 TRIAZOLOPYRIMIDINE DERIVATIVES FOR USE AS GHRELIN O-ACYL TRANSFERASE (GOAT) INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2019-08-08 WO disclosed
EP-3252049-A1 PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS Bristol-Myers Squibb Company (US) 2017-12-06 EP disclosed
EP-3252050-A1 PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS Bristol-Myers Squibb Company (US) 2017-12-06 EP disclosed