SCHEMBL24212971

SCHEMBL24212971

O=C(OC12CC3CC(C1)CC(OC(=O)c1ccc([N+](=O)[O-])cc1)(C3)C2)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
PTPN2 P17706 1/20 0.48
PTPN1 P18031 1/20 0.48
POLB P06746 2/20 0.46
KMT2A Q03164 2/20 0.46
PKM P14618 1/20 0.46
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
CES1 P23141 1/20 0.44
PGR P06401 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
MEN1 O00255 1/20 0.42
TSHR P16473 1/20 0.41

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
SCHEMBL6363107 0.92 PTPN2 (0.50) NPC1RAB9APTPN2PTPN1POLB
SCHEMBL26343319 0.90 ALDH1A1 (0.44) NPC1RAB9APTPN2PTPN1POLB
SCHEMBL24213064 0.80 POLB (0.48) NPC1RAB9APOLBKMT2APKM
SCHEMBL17344396 0.79 FAAH (0.45) POLBKMT2AALDH1A1TSHR
SCHEMBL26240669 0.77 PDCD1 (0.43) NPC1RAB9APOLBKMT2AALDH1A1
SCHEMBL15383082 0.77 NPC1 (0.50) NPC1RAB9AKMT2APKMALDH1A1
SCHEMBL11249248 0.77 KMT2A (0.35) NPC1RAB9APTPN2PTPN1POLB
SCHEMBL12500713 0.75 KMT2A (0.45) NPC1RAB9APOLBKMT2AALDH1A1
SCHEMBL26240810 0.75 HSP90AA1 (0.40) NPC1RAB9ASMN1; SMN2TDP1
SCHEMBL14253144 0.74 CKS1B (0.50) PTPN2PTPN1POLBKMT2APKM

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-20220019144-A1 PHOTOSENSITIVE RESIN COMPOSITION, FILM, AND ELECTRONIC DEVICE DUKSAN TECHOPIA CO. LTD. (KR) 2022-01-20 US disclosed