SCHEMBL24178233

SCHEMBL24178233

CCCC[N+]1(CCCCC[N+]2(CCC)CCCC2)CCCC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
TSHR P16473 1/20 0.32
THRB P10828 1/20 0.32
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL24178232 1.00 NPC1 (0.33) NPC1RAB9ATSHRTHRBGNAI3
SCHEMBL898854 0.95 TSHR (0.38) NPC1RAB9ATSHRTHRBGNAI3
SCHEMBL5292936 0.95 TSHR (0.38) NPC1RAB9ATSHRTHRBGNAI3
SCHEMBL899304 0.95 TSHR (0.38) NPC1RAB9ATSHRTHRBGNAI3
SCHEMBL5301482 0.95 TSHR (0.38) NPC1RAB9ATSHRTHRBGNAI3
SCHEMBL898432 0.95 TSHR (0.38) NPC1RAB9ATSHRTHRBGNAI3
SCHEMBL899029 0.95 TSHR (0.38) NPC1RAB9ATSHRTHRBGNAI3
SCHEMBL898140 0.95 TSHR (0.38) NPC1RAB9ATSHRTHRBGNAI3
SCHEMBL5283911 0.95 TSHR (0.38) NPC1RAB9ATSHRTHRBGNAI3
SCHEMBL5293597 0.95 TSHR (0.38) NPC1RAB9ATSHRTHRBGNAI3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220004101-A1 CHEMICALLY AMPLIFIED RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-01-06 US disclosed