SCHEMBL19786645

SCHEMBL19786645

c1ccc2c(c1)ccc1c2sc2c3ccccc3c3c(c4ccccc4n3-c3cc4ccc5cccc6ccc(c3)c4c56)c12

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 0.38
ERBB2 P04626 1/20 0.38
FYN P06241 1/20 0.38
MAOA P21397 1/20 0.38
ACHE P22303 1/20 0.38
AHR P35869 1/20 0.38
CYP1A1 P04798 5/20 0.36
CYP1B1 Q16678 5/20 0.36
RAB9A P51151 1/20 0.33
NQO1 P15559 1/20 0.32
NQO2 P16083 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
ALDH1A1 P00352 1/20 0.30
THRB P10828 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL19786550 0.90 PMM2 (0.36) CYP1A2CYP1A1CYP1B1RAB9AALDH1A1
SCHEMBL19786533 0.90 CYP1B1 (0.34) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL19786320 0.90 KDM4E (0.35) CYP1A2CYP1A1CYP1B1RAB9ATDP1
SCHEMBL19786535 0.88 ATM (0.41) CYP1A2CYP1A1CYP1B1TDP1ALDH1A1
SCHEMBL19786641 0.87 CYP1A1 (0.40) CYP1A2CYP1A1CYP1B1
SCHEMBL19786644 0.86 CYP1A1 (0.41) CYP1A2CYP1A1CYP1B1ALDH1A1
SCHEMBL19786544 0.84 MEN1 (0.33) CYP1A2CYP1A1CYP1B1RAB9A
SCHEMBL20311588 0.83 CYP1A2 (0.46) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL19786553 0.80 CYP3A4 (0.32) ACHECYP1A1CYP1B1
SCHEMBL15126929 0.80 CYP1A1 (0.34) CYP1A2CYP1A1CYP1B1RAB9AALDH1A1

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-20190300535-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2019-10-03 US disclosed
WO-2018012781-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2018-01-18 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-20190300535-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF ORC3, OR51E2, ORAI2 CYP1A2 2971/4885ERBB2 3597/4885FYN 1338/4885

“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.