SCHEMBL21532335

SCHEMBL21532335

c1ccc(-c2nc(-c3ccccc3)n(-c3cccc4c5ccccc5n(-c5ccccc5-n5c6ccccc6c6ccc7c8ccccc8oc7c65)c34)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H3 Q13133 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
NR1H2 P55055 1/20 0.33
MAPT P10636 4/20 0.32
TSHR P16473 3/20 0.32
PTGER1 P34995 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
ADORA1 P30542 1/20 0.32
LMNA P02545 3/20 0.31
POLB P06746 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ALDH1A1 P00352 2/20 0.30
GAA P10253 1/20 0.30
CASP3 P42574 1/20 0.30
SENP8 Q96LD8 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
SCHEMBL21532491 0.93 MEN1 (0.32) MAPTTSHRKMT2AGAA
SCHEMBL21532421 0.91 PTGER1 (0.32) NR1H3NPC1RAB9ANR1H2MAPT
SCHEMBL21532423 0.88 SMN1; SMN2 (0.32) MAPTTSHR
SCHEMBL21532134 0.88 KDM4A (0.37) MAPT
SCHEMBL21532205 0.88 NPC1 (0.33) NR1H3NPC1RAB9ANR1H2ADORA3
SCHEMBL21532238 0.86 CA12 (0.31) KMT2AGAA
SCHEMBL21532435 0.86 CA12 (0.31) KMT2AGAA
SCHEMBL21532427 0.85 PTGER4 (0.34) TSHRPTGER1
SCHEMBL21532479 0.85 NPC1 (0.31) NR1H3NPC1RAB9ANR1H2ADORA3
SCHEMBL21532703 0.85 NPC1 (0.31) NR1H3NPC1RAB9ANR1H2ADORA3

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
US-11145825-B2 Condensed cyclic compound and organic light-emitting device including i he same SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-10-12 US disclosed
US-20190334095-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-10-31 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 (2 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-11145825-B2 Condensed cyclic compound and organic light-emitting device including i he same CRY1, CCNT1, CCNA1 NR1H3 621/4885NPC1 1879/4885RAB9A 1780/4885
US-20190334095-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CCNT1, ARL1 NR1H3 904/4885NPC1 2440/4885RAB9A 2046/4885

“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.