SCHEMBL19439005

SCHEMBL19439005

CC(C)N1CCN(c2nc3ccc(Br)nc3s2)CC1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OGA O60502 7/20 0.40
RAB9A P51151 8/20 0.40
NPC1 O15118 7/20 0.40
MAPT P10636 3/20 0.40
HRH3 Q9Y5N1 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
CYP1A2 P05177 1/20 0.35
POLB P06746 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 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
SCHEMBL19454673 0.81 HRH3 (0.44) RAB9ANPC1MAPTHRH3ALDH1A1
SCHEMBL21588424 0.78 NPC1 (0.54) RAB9ANPC1MAPTHRH3ALDH1A1
SCHEMBL19449840 0.78 SCN4A (0.46) RAB9ANPC1MAPTHRH3ALDH1A1
SCHEMBL19435033 0.78 RAB9A (0.46) RAB9ANPC1MAPTALDH1A1KDM4E
Hydrochloric Acid SCHEMBL29504646 0.77 SCN4A (0.45) RAB9ANPC1MAPTHRH3ALDH1A1
Hydrochloric Acid SCHEMBL19435027 0.77 SCN4A (0.45) RAB9ANPC1MAPTHRH3ALDH1A1
SCHEMBL3469499 0.74 RAB9A (0.55) OGARAB9ANPC1MAPTALDH1A1
SCHEMBL19438974 0.74 RAB9A (0.40) OGARAB9ANPC1HRH3ALDH1A1
SCHEMBL15333499 0.73 HRH3 (0.44) OGARAB9AMAPTHRH3ALDH1A1
SCHEMBL19434953 0.73 CNR2 (0.50) HRH3CYP2C19

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-3440087-A1 THIAZOLOPYRIDINE DERIVATIVES AS GPR119 AGONISTS MANKIND PHARMA LTD (IN) 2019-02-13 EP disclosed
WO-2017175068-A1 THIAZOLOPYRIDINE DERIVATIVES AS GPR119 AGONISTS MANKIND PHARMA LTD. (IN) 2017-10-12 WO disclosed