SCHEMBL17167459

SCHEMBL17167459

c1ccc2cc(-c3ccc4cc(-c5ccc(-c6cccc7c6oc6c8ccccc8ccc76)cc5)ccc4c3)ccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A1 P04798 12/20 0.54
▸ CYP1B1 Q16678 12/20 0.54
▸ PRKDC P78527 4/20 0.45
▸ CYP1A2 P05177 11/20 0.42
▸ ABCB1 P08183 2/20 0.42
▸ ABCC1 P33527 2/20 0.42
▸ ABCG2 Q9UNQ0 2/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ TSHR P16473 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ PDE5A O76074 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ CYP19A1 P11511 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ CYP2B6 P20813 1/20 0.42

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
SCHEMBL17268976 0.91 CYP1A1 (0.51) CYP1A1CYP1B1PRKDCCYP1A2ABCB1
SCHEMBL17167460 0.91 CYP1A1 (0.43) CYP1A1CYP1B1PRKDCCYP1A2ABCB1
SCHEMBL17944494 0.90 CYP1A1 (0.50) CYP1A1CYP1B1PRKDCCYP1A2ABCB1
SCHEMBL22175040 0.89 PRKDC (0.46) CYP1A1CYP1B1PRKDCCYP1A2KDM4E
SCHEMBL22174875 0.89 PRKDC (0.46) CYP1A1CYP1B1PRKDCCYP1A2KDM4E
SCHEMBL20334472 0.89 CYP1A1 (0.49) CYP1A1CYP1B1PRKDCCYP1A2ABCB1
SCHEMBL24384300 0.88 CYP1A1 (0.46) CYP1A1CYP1B1PRKDCCYP1A2ABCB1
SCHEMBL1636367 0.87 PRKDC (0.52) CYP1A1CYP1B1PRKDCCYP1A2CYP3A4
SCHEMBL21035461 0.87 ARSA (0.44) CYP1A1CYP1B1PRKDCCYP1A2ABCB1
SCHEMBL24888269 0.87 CYP1A1 (0.43) CYP1A1CYP1B1PRKDCCYP1A2ABCB1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10038152-B2 Organic light-emitting element CANON KABUSHIKI KAISHA (JP) 2018-07-31 — — US disclosed
US-10038152-B2 Organic light-emitting element CANON KABUSHIKI KAISHA (JP) 2018-07-31 — — US disclosed
US-9899613-B2 Organic light-emitting element CANON KABUSHIKI KAISHA (JP) 2018-02-20 — — US disclosed
US-9899613-B2 Organic light-emitting element CANON KABUSHIKI KAISHA (JP) 2018-02-20 — — US disclosed
US-20150372244-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-12-24 — — US disclosed
US-20150372244-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-12-24 — — US disclosed
US-20150357586-A1 ORGANIC LIGHT-EMITTING ELEMENT SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-12-10 — — US disclosed
US-20150357586-A1 ORGANIC LIGHT-EMITTING ELEMENT SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-12-10 — — US disclosed
US-20150295188-A1 ORGANIC LIGHT-EMITTING ELEMENT SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-10-15 — — US disclosed
US-20150295188-A1 ORGANIC LIGHT-EMITTING ELEMENT SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-10-15 — — 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-10038152-B2 Organic light-emitting element NFE2L2, EML4, LEF1 CYP1A1 504/4885CYP1B1 1086/4885PRKDC 4155/4885

“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.

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