SCHEMBL19832015

SCHEMBL19832015

c1ccc2c(c1)ccc1c3cc4[nH]c5ccccc5c4cc3sc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.53
KIF11 P52732 10/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
TNKS O95271 1/20 0.43
TNKS2 Q9H2K2 1/20 0.43
TOP2A P11388 1/20 0.41
ALDH1A1 P00352 2/20 0.41
GPR3 P46089 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CYP1A1 P04798 3/20 0.38
CYP1B1 Q16678 3/20 0.38
CYP1A2 P05177 2/20 0.38
HTT P42858 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HCRTR1 O43613 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL19636291 0.94 AHR (0.49) AHRKIF11MEN1KMT2AMAPT
SCHEMBL19831907 0.91 CYP1B1 (0.41) AHRKIF11MEN1KMT2AMAPT
SCHEMBL19636226 0.87 KIF11 (0.53) AHRKIF11MEN1KMT2AMAPT
SCHEMBL19832012 0.86 CDK4 (0.41) AHRKIF11MEN1KMT2ARAB9A
SCHEMBL19636281 0.85 CYP1B1 (0.41) AHRKIF11MEN1KMT2AMAPT
SCHEMBL12070495 0.84 CYP1B1 (0.49) AHRMAPTRAB9AALDH1A1GPR3
SCHEMBL18553280 0.84 AHR (0.55) AHRKIF11MEN1KMT2AMAPT
SCHEMBL19831909 0.81 AHR (0.60) AHRKIF11MEN1KMT2AMAPT
SCHEMBL19831792 0.81 KIF11 (0.53) AHRKIF11MEN1KMT2AMAPT
SCHEMBL18665825 0.81 AHR (0.50) AHRKIF11MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11205755-B2 Compound for organic electronic element, organic electronic element using same, and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2021-12-21 US disclosed
US-20190189927-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2019-06-20 US disclosed
WO-2018021737-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2018-02-01 WO 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-11205755-B2 Compound for organic electronic element, organic electronic element using same, and electronic device thereof PIEZO1, OR51E2, ORAI2 AHR 3841/4885KIF11 3407/4885MEN1 625/4885

“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.