SCHEMBL19080020

SCHEMBL19080020

c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5cc6c(cc5c4)oc4c5ccccc5ccc64)c4ccccc34)c3ccccc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 11/20 0.41
CYP1B1 Q16678 11/20 0.41
CYP1A2 P05177 10/20 0.40
ABCG2 Q9UNQ0 4/20 0.40
ABCC1 P33527 3/20 0.40
ABCB1 P08183 2/20 0.40
PRKDC P78527 2/20 0.40
KDM4E B2RXH2 1/20 0.40
PDE5A O76074 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
CYP19A1 P11511 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
CYP2B6 P20813 1/20 0.40
TACR2 P21452 1/20 0.40

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
SCHEMBL19080021 0.96 CYP1A1 (0.40) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL19080083 0.94 CYP1A1 (0.45) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL19080051 0.92 CYP1A1 (0.42) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL19076402 0.91 ALOX5 (0.40) CYP1A1CYP1B1PRKDCKDM4EALDH1A1
SCHEMBL19080086 0.90 CYP1A1 (0.43) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL19079925 0.90 CYP1A1 (0.45) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL19080036 0.90 CYP1A1 (0.45) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL17931955 0.90 CYP1A1 (0.44) CYP1A1CYP1B1CYP1A2ABCG2ABCC1
SCHEMBL19080019 0.90 ESR1 (0.41) CYP1A1CYP1A2ABCG2KDM4EALDH1A1
SCHEMBL19080052 0.89 CYP1A1 (0.42) CYP1A1CYP1B1CYP1A2ABCG2ABCC1

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-10580999-B2 Condensed cyclic compound and an organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-03-03 US disclosed
US-20170194571-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 US disclosed
US-20170194571-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-20170194571-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNA1 CYP1A1 147/4885CYP1B1 225/4885CYP1A2 621/4885
US-10580999-B2 Condensed cyclic compound and an organic light-emitting device including the same CRY1, CRY2, CCNA1 CYP1A1 147/4885CYP1B1 225/4885CYP1A2 621/4885

“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.