SCHEMBL19082206

SCHEMBL19082206

c1ccc(-c2ccc3cc(-c4c5ccccc5c(-c5cc6sc7ccccc7c6c6c5sc5c7ccccc7ccc56)c5ccccc45)ccc3c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 5/20 0.38
CYP1B1 Q16678 5/20 0.38
CYP1A2 P05177 3/20 0.33
F9 P00740 3/20 0.33
ESR1 P03372 2/20 0.32
ESR2 Q92731 2/20 0.32
NQO1 P15559 1/20 0.31
NQO2 P16083 1/20 0.31
S1PR4 O95977 2/20 0.31
S1PR5 Q9H228 2/20 0.31
CHEK1 O14757 1/20 0.31
WEE1 P30291 1/20 0.31
PTPN1 P18031 1/20 0.31
SOS1 Q07889 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
SCHEMBL19082142 0.94 CYP1A1 (0.35) CYP1A1CYP1B1CYP1A2NQO1NQO2
SCHEMBL19082349 0.92 CYP1A1 (0.39) CYP1A1CYP1B1CYP1A2F9ESR1
SCHEMBL17945507 0.92 PTPN1 (0.36) F9ESR1ESR2S1PR4S1PR5
SCHEMBL19091020 0.91 CYP1A1 (0.32) CYP1A1CYP1B1
SCHEMBL19082387 0.88 CYP1A1 (0.35) CYP1A1CYP1B1CYP1A2NQO1NQO2
SCHEMBL19082190 0.87 CYP1A1 (0.40) CYP1A1CYP1B1CYP1A2F9NQO1
SCHEMBL17945678 0.87 PTPN1 (0.37) NQO1NQO2S1PR4S1PR5PTPN1
SCHEMBL19082311 0.85 CYP1A1 (0.39) CYP1A1CYP1B1CYP1A2NQO1NQO2
SCHEMBL17945699 0.85 PTPN1 (0.36) CYP1A1CYP1B1CYP1A2F9ESR1
SCHEMBL17945084 0.83 ALOX5 (0.36) ESR1ESR2S1PR4S1PR5CHEK1

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-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 (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-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.