SCHEMBL19082227

SCHEMBL19082227

c1ccc2c(-c3c4ccccc4c(-c4ccc(-c5ccc6sc7ccc8c(sc9ccc%10ccccc%10c98)c7c6c5)cc4)c4ccccc34)cccc2c1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.34
CA12 O43570 4/20 0.34
CA1 P00915 4/20 0.34
CA2 P00918 4/20 0.34
CA9 Q16790 4/20 0.34
CYP1A1 P04798 4/20 0.33
CYP1B1 Q16678 4/20 0.33
CYP1A2 P05177 2/20 0.33
LIMK1 P53667 1/20 0.33
NQO2 P16083 2/20 0.33
NQO1 P15559 1/20 0.33
SOS1 Q07889 1/20 0.32
F9 P00740 1/20 0.30
ALK Q9UM73 1/20 0.30
PTPN1 P18031 1/20 0.30
PIM3 Q86V86 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
SCHEMBL19082107 0.95 ALOX5 (0.36) ALOX5CA12CA1CA2CA9
SCHEMBL17945337 0.95 CA12 (0.36) ALOX5CA12CA1CA2CA9
SCHEMBL19082254 0.94 CYP1A1 (0.34) ALOX5CA12CA1CA2CA9
SCHEMBL19082372 0.94 ALOX5 (0.34) ALOX5CA12CA1CA2CA9
SCHEMBL17944198 0.93 ALOX5 (0.42) ALOX5CA12CA1CA2CA9
SCHEMBL19082351 0.92 ALOX5 (0.38) ALOX5CA12CA1CA2CA9
SCHEMBL17932215 0.91 ALOX5 (0.40) ALOX5CA12CA1CA2CA9
SCHEMBL19082228 0.91 CYP1A1 (0.38) ALOX5CA12CA1CA2CA9
SCHEMBL19082236 0.91 CA12 (0.34) CA12CA1CA2CA9NQO2
SCHEMBL19082208 0.90 LIMK1 (0.40) CYP1A1CYP1B1CYP1A2LIMK1NQO2

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 ALOX5 1939/4885CA12 1240/4885CA1 1455/4885
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 ALOX5 1939/4885CA12 1240/4885CA1 1455/4885

“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.