SCHEMBL19082172

SCHEMBL19082172

c1cc(-c2ccc3ccccc3c2)cc(-c2c3ccccc3c(-c3cc4c(sc5ccc6ccccc6c54)c4sc5ccccc5c34)c3ccccc23)c1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.34
NQO1 P15559 1/20 0.33
NQO2 P16083 1/20 0.33
HSD17B1 P14061 1/20 0.33
HSD17B2 P37059 1/20 0.33
S1PR5 Q9H228 7/20 0.32
S1PR4 O95977 6/20 0.32
ALOX5 P09917 1/20 0.32
CYP1A1 P04798 1/20 0.30
CYP1B1 Q16678 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
SCHEMBL19082314 0.94 ALOX5 (0.35) PTPN1NQO1NQO2HSD17B1HSD17B2
SCHEMBL17944206 0.91 ALOX5 (0.37) PTPN1HSD17B1HSD17B2S1PR5S1PR4
SCHEMBL19082386 0.89 ALOX5 (0.37) PTPN1NQO1NQO2S1PR5S1PR4
SCHEMBL17944280 0.86 HSD17B1 (0.37) NQO1NQO2HSD17B1HSD17B2S1PR5
SCHEMBL17932070 0.86 PTPN1 (0.40) PTPN1NQO1NQO2S1PR5S1PR4
SCHEMBL17944217 0.85 ALOX5 (0.40) PTPN1HSD17B1HSD17B2S1PR5S1PR4
SCHEMBL19082164 0.85 HSD17B1 (0.36) NQO1NQO2HSD17B1HSD17B2S1PR5
SCHEMBL19082232 0.85 PTPN1 (0.38) PTPN1NQO1NQO2ALOX5CYP1A1
SCHEMBL19082121 0.85 NQO2 (0.37) PTPN1NQO1NQO2ALOX5
SCHEMBL19082168 0.85 NQO1 (0.33) PTPN1NQO1NQO2HSD17B1HSD17B2

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-10553800-B2 Condensed cyclic compound and an organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-02-04 US disclosed
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 US disclosed
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 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-10553800-B2 Condensed cyclic compound and an organic light-emitting device including the same CRY1, CRY2, CCNT1 PTPN1 4695/4885NQO1 576/4885NQO2 2592/4885
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 PTPN1 4695/4885NQO1 576/4885NQO2 2592/4885

“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.