SCHEMBL22326540

SCHEMBL22326540

c1ccc2c(c1)-c1ccccc1C21c2cccc(-c3nc4ccccc4[nH]3)c2-c2c1sc1ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 5/20 0.43
MAPT P10636 4/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
XBP1 P17861 1/20 0.43
BLM P54132 1/20 0.43
ALDH1A1 P00352 10/20 0.41
RAB9A P51151 9/20 0.41
NPC1 O15118 9/20 0.41
KDM4E B2RXH2 9/20 0.41
HPGD P15428 8/20 0.41
HSD17B10 Q99714 6/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 8/20 0.41
PKM P14618 2/20 0.41
HTT P42858 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
GLA P06280 1/20 0.41
GAA P10253 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
SCHEMBL22326548 0.84 NPSR1 (0.45) NPSR1MAPTMEN1KMT2AXBP1
SCHEMBL22326547 0.81 NPSR1 (0.42) NPSR1MAPTMEN1KMT2AXBP1
SCHEMBL20174675 0.79 KDM4E (0.45) NPSR1MAPTMEN1KMT2AALDH1A1
SCHEMBL20174678 0.77 AR (0.38) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL22326544 0.76 RAB9A (0.43) NPSR1MAPTMEN1KMT2AALDH1A1
SCHEMBL20174666 0.76 ACACA (0.38) NPSR1MAPTALDH1A1RAB9AKDM4E
SCHEMBL20174740 0.73 GPR3 (0.40) NPSR1MAPTMEN1KMT2ABLM
SCHEMBL21298308 0.73 NPC1 (0.51) NPSR1MAPTMEN1KMT2AXBP1
SCHEMBL21298125 0.73 NPC1 (0.51) NPSR1MAPTMEN1KMT2AXBP1
SCHEMBL20174577 0.72 ADORA2A (0.32) MAPTALDH1A1KDM4EHPGDHSD17B10

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-10738034-B2 Spiro compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2020-08-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10738034-B2 Spiro compound and organic light-emitting device comprising same CRY1, NR2E3, ERG NPSR1 3257/4885MAPT 811/4885MEN1 611/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.