SCHEMBL19831907

SCHEMBL19831907

c1ccc2cc3c(cc2c1)[nH]c1cc2c(cc13)sc1c3ccccc3ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 6/20 0.41
CYP1A1 P04798 5/20 0.41
AHR P35869 1/20 0.41
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
KDM4E B2RXH2 2/20 0.40
HPGD P15428 2/20 0.40
HCRTR1 O43613 1/20 0.40
CYP1A2 P05177 4/20 0.38
TNKS O95271 3/20 0.38
TNKS2 Q9H2K2 3/20 0.38
MAPT P10636 2/20 0.37
RAB9A P51151 2/20 0.37
KIF11 P52732 1/20 0.36
TOP2A P11388 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
PPARG P37231 1/20 0.35

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
SCHEMBL19636281 0.94 CYP1B1 (0.41) CYP1B1CYP1A1AHRALDH1A1MEN1
SCHEMBL19832015 0.91 AHR (0.53) CYP1B1CYP1A1AHRALDH1A1MEN1
SCHEMBL19636226 0.87 KIF11 (0.53) CYP1B1CYP1A1AHRALDH1A1MEN1
SCHEMBL19832012 0.86 CDK4 (0.41) CYP1B1CYP1A1AHRALDH1A1MEN1
SCHEMBL19636291 0.85 AHR (0.49) CYP1B1CYP1A1AHRALDH1A1MEN1
SCHEMBL30581080 0.84 CYP1B1 (0.46) CYP1B1CYP1A1AHRALDH1A1NPSR1
SCHEMBL14101422 0.84 CYP1B1 (0.46) CYP1B1CYP1A1AHRALDH1A1NPSR1
SCHEMBL12070495 0.84 CYP1B1 (0.49) CYP1B1CYP1A1AHRALDH1A1NPSR1
SCHEMBL18665993 0.84 MAPT (0.41) CYP1B1CYP1A1AHRALDH1A1MEN1
SCHEMBL21942082 0.83 GPR3 (0.48) AHRALDH1A1MEN1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230240141-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2023-07-27 US disclosed
US-20230240141-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2023-07-27 US disclosed
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 (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-20230240141-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREOF ESR1, GPX1, LEF1 CYP1B1 452/4885CYP1A1 130/4885AHR 1108/4885
US-11205755-B2 Compound for organic electronic element, organic electronic element using same, and electronic device thereof PIEZO1, OR51E2, ORAI2 CYP1B1 4395/4885CYP1A1 3577/4885AHR 3841/4885

“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.