SCHEMBL19081794

SCHEMBL19081794

c1ccc2cc(-c3c4ccccc4c(-c4ccc5sc6cc7c(cc6c5c4)oc4c5ccccc5ccc74)c4ccccc34)ccc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 14/20 0.43
CYP1B1 Q16678 14/20 0.43
CYP1A2 P05177 12/20 0.35
ABCC1 P33527 3/20 0.35
ABCG2 Q9UNQ0 3/20 0.35
ABCB1 P08183 2/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 2/20 0.34
PRKDC P78527 2/20 0.34
ALOX15 P16050 1/20 0.34
HTT P42858 1/20 0.34
PDE5A O76074 1/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPT P10636 1/20 0.34
CYP19A1 P11511 1/20 0.34
CYP2C9 P11712 1/20 0.34

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
SCHEMBL19081961 0.92 CYP1A1 (0.41) CYP1A1CYP1B1CYP1A2ABCC1ABCG2
SCHEMBL19081820 0.92 CYP1A1 (0.39) CYP1A1CYP1B1CYP1A2ABCC1ABCG2
SCHEMBL19081842 0.90 CYP1A1 (0.41) CYP1A1CYP1B1CYP1A2ABCC1ABCG2
SCHEMBL23427978 0.88 CYP1A1 (0.37) CYP1A1CYP1B1CYP1A2ABCC1ABCG2
SCHEMBL19081852 0.88 CYP1A1 (0.36) CYP1A1CYP1B1CYP1A2ABCC1ABCG2
SCHEMBL17931989 0.87 CYP1A1 (0.38) CYP1A1CYP1B1CYP1A2ABCC1ABCG2
SCHEMBL18268514 0.87 AHR (0.37) CYP1A1CYP1B1CYP1A2KDM4EALDH1A1
SCHEMBL16067771 0.87 CYP1A1 (0.38) CYP1A1CYP1B1CYP1A2ABCC1ABCG2
SCHEMBL19080179 0.87 CYP1A1 (0.38) CYP1A1CYP1B1CYP1A2ABCC1ABCG2
SCHEMBL19081710 0.86 CYP1A1 (0.36) CYP1A1CYP1B1CYP1A2ABCC1ABCG2

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 CYP1A1 184/4885CYP1B1 260/4885CYP1A2 659/4885
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 CYP1A1 184/4885CYP1B1 260/4885CYP1A2 659/4885

“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.