SCHEMBL822732

SCHEMBL822732

c1ccc(-c2cc(-c3ccccc3)n(-c3ccc4c(c3)-c3cc(-n5nc(-c6ccccc6)cc5-c5ccccc5)ccc3C4)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP8 P40818 1/20 0.48
CYP2C9 P11712 1/20 0.47
MMP2 P08253 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
FABP3 P05413 7/20 0.43
FABP4 P15090 7/20 0.43
EGFR P00533 1/20 0.41
RPA1 P27694 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
MCL1 Q07820 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL10038494 0.79 CYP2C9 (0.62) USP8CYP2C9MMP2NPC1RAB9A
SCHEMBL16432877 0.79 CYP2C9 (0.62) USP8CYP2C9MMP2NPC1RAB9A
SCHEMBL11910198 0.79 RAB9A (0.56) USP8CYP2C9NPC1RAB9AFABP3
SCHEMBL1198398 0.79 RAB9A (0.65) USP8CYP2C9MMP2NPC1RAB9A
SCHEMBL3852411 0.77 RAB9A (0.62) USP8CYP2C9MMP2NPC1RAB9A
SCHEMBL3857283 0.76 RAB9A (0.61) USP8CYP2C9MMP2NPC1RAB9A
SCHEMBL24157480 0.75 CYP2C9 (0.73) USP8CYP2C9MMP2NPC1RAB9A
SCHEMBL2816383 0.75 USP8 (0.76) USP8CYP2C9MMP2NPC1RAB9A
SCHEMBL14132548 0.75 USP8 (0.59) USP8CYP2C9NPC1RAB9AFABP3
SCHEMBL3446308 0.75 ALDH1A1 (0.64) USP8CYP2C9MMP2NPC1RAB9A

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-9067919-B2 Use of dibenzofurans and dibenzothiophenes substituted by nitrogen-bonded five-membered heterocyclic rings in organic electronics BASF SE (DE) 2015-06-30 US disclosed
US-20120007063-A1 USE OF DIBENZOFURANS AND DIBENZOTHIOPHENES SUBSTITUTED BY NITROGEN-BONDED FIVE-MEMBERED HETEROCYCLIC RINGS IN ORGANIC ELECTRONICS BASF SE (DE) 2012-01-12 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-20120007063-A1 USE OF DIBENZOFURANS AND DIBENZOTHIOPHENES SUBSTITUTED BY NITROGEN-BONDED FIVE-MEMBERED HETEROCYCLIC RINGS IN ORGANIC ELECTRONICS DDT, DBF4, POU5F1 USP8 3974/4885CYP2C9 575/4885MMP2 4609/4885

“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.