SCHEMBL19077331

SCHEMBL19077331

c1cc(-c2ccc3ccc4c5cc6c(cc5sc4c3c2)sc2ccccc26)cc(-c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.40
CYP1A1 P04798 5/20 0.36
CYP1B1 Q16678 5/20 0.36
CYP1A2 P05177 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
F9 P00740 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
PRKDC P78527 1/20 0.32
PARP14 Q460N5 1/20 0.31
GPR3 P46089 1/20 0.31
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
POLB P06746 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
SCHEMBL19123357 0.96 ALOX5 (0.39) ALOX5CYP1A1CYP1B1CYP1A2ALDH1A1
SCHEMBL19109300 0.96 ALOX5 (0.39) ALOX5CYP1A1CYP1B1CYP1A2ALDH1A1
SCHEMBL19109306 0.94 ALOX5 (0.39) ALOX5CYP1A1CYP1B1CYP1A2ALDH1A1
SCHEMBL19109294 0.94 ALOX5 (0.39) ALOX5CYP1A1CYP1B1CYP1A2ALDH1A1
SCHEMBL19082273 0.93 CYP1A1 (0.40) ALOX5CYP1A1CYP1B1CYP1A2CA12
SCHEMBL19077440 0.91 ALOX5 (0.40) ALOX5CYP1A1CYP1B1CYP1A2ALDH1A1
SCHEMBL19077366 0.91 CYP1A1 (0.37) ALOX5CYP1A1CYP1B1CYP1A2ALDH1A1
SCHEMBL19077291 0.91 CYP1A1 (0.39) ALOX5CYP1A1CYP1B1CYP1A2ALDH1A1
SCHEMBL17944632 0.91 ALDH1A1 (0.38) ALOX5CYP1A1CYP1B1ALDH1A1MAPT
SCHEMBL24342934 0.91 ALOX5 (0.45) ALOX5CYP1A1CYP1B1CYP1A2ALDH1A1

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-20170194573-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 US disclosed
US-20170194573-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 (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-20170194573-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 ALOX5 1939/4885CYP1A1 184/4885CYP1B1 260/4885

“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.