SCHEMBL28905992

SCHEMBL28905992

Cc1ncccc1C(N)=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.65
PARP1 P09874 3/20 0.56
MKNK1 Q9BUB5 1/20 0.54
MKNK2 Q9HBH9 1/20 0.54
RAB9A P51151 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
MAPT P10636 3/20 0.54
NPC1 O15118 1/20 0.54
AHR P35869 1/20 0.54
KDM4E B2RXH2 4/20 0.51
ALDH1A1 P00352 3/20 0.51
HPGD P15428 2/20 0.51
HSD17B10 Q99714 1/20 0.51
NAPRT Q6XQN6 1/20 0.47
NNMT P40261 1/20 0.46
TDP1 Q9NUW8 2/20 0.46
SIRT3 Q9NTG7 1/20 0.46
HTT P42858 1/20 0.45
CYP3A4 P08684 1/20 0.44
ALOX15 P16050 1/20 0.44

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
SCHEMBL129457 1.00 P2RX7 (0.65) P2RX7PARP1MKNK1MKNK2RAB9A
Hydrochloric Acid SCHEMBL5010797 0.98 P2RX7 (0.62) P2RX7PARP1MKNK1MKNK2RAB9A
Fluoride SCHEMBL22032488 0.98 P2RX7 (0.62) P2RX7PARP1MKNK1MKNK2RAB9A
Ammonia Solution, Strong SCHEMBL28560460 0.98 P2RX7 (0.62) P2RX7PARP1MKNK1MKNK2RAB9A
Hydrochloric Acid SCHEMBL3086243 0.98 P2RX7 (0.62) P2RX7PARP1MKNK1MKNK2RAB9A
SCHEMBL28331539 0.98 P2RX7 (0.62) P2RX7PARP1MKNK1MKNK2RAB9A
SCHEMBL22032484 0.94 P2RX7 (0.59) P2RX7PARP1MKNK1MKNK2RAB9A
Cyanide SCHEMBL28204544 0.94 P2RX7 (0.59) P2RX7PARP1MKNK1MKNK2RAB9A
SCHEMBL29082826 0.93 P2RX7 (0.62) P2RX7PARP1MKNK1MKNK2RAB9A
SCHEMBL22032483 0.91 P2RX7 (0.56) P2RX7PARP1MKNK1MKNK2RAB9A

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-2638045-B1 AMINOALCOHOL SUBSTITUTED 2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLINE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS BAYER IP GMBH (DE) 2022-08-31 EP claimed
EP-4551566-A1 NEW SPIROCYCLOHEXANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS ANTI-APOPTOTIC INHIBITORS Les Laboratoires Servier (FR) 2025-05-14 EP disclosed
WO-2024008941-A1 NEW SPIROCYCLOHEXANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS ANTI-APOPTOTIC INHIBITORS LES LABORATOIRES SERVIER (FR) 2024-01-11 WO disclosed
CN-110484604-B In-situ cell RNA tailing and structure imaging method 西安交通大学 2021-01-19 CN disclosed