SCHEMBL18267698

SCHEMBL18267698

O=Cc1cc(Cl)ccc1-c1cccc2c1oc1ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.51
AHR P35869 4/20 0.46
PRKDC P78527 4/20 0.42
HDAC8 Q9BY41 1/20 0.41
ERN1 O75460 1/20 0.41
PIK3CD O00329 1/20 0.39
PIK3CB P42338 1/20 0.39
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
GABRB2 P47870 1/20 0.38
GABRA4 P48169 1/20 0.38
GABRE P78334 1/20 0.38
GABRA6 Q16445 1/20 0.38

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
SCHEMBL24274999 0.93 AHR (0.49) ALOX5AHRPRKDCHDAC8ERN1
SCHEMBL19398804 0.84 ALOX5 (0.53) ALOX5PRKDCHDAC8PIK3CDPIK3CB
SCHEMBL22738104 0.81 AHR (0.71) ALOX5AHRPRKDCPIK3CDPIK3CB
SCHEMBL24637019 0.81 ERN1 (0.38) ERN1PTPN1TNKS
SCHEMBL16745220 0.79 ALOX5 (0.55) ALOX5AHRPRKDCHDAC8PIK3CD
SCHEMBL15989894 0.79 ALOX5 (0.55) ALOX5AHRPRKDCHDAC8PIK3CD
SCHEMBL30790120 0.79 ALOX5 (0.55) ALOX5AHRPRKDCHDAC8PIK3CD
SCHEMBL16491694 0.79 ALOX5 (0.55) ALOX5AHRPRKDCHDAC8PIK3CD
SCHEMBL18620516 0.78 ALOX5 (0.51) ALOX5AHRPRKDCHDAC8PIK3CD
SCHEMBL21510808 0.78 ALOX5 (0.55) ALOX5AHRPRKDCHDAC8GGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190326517-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2019-10-24 US disclosed
US-10446760-B2 Organic compound, organic optoelectric diode, and display device SAMSUNG SDI CO., LTD. (KR) 2019-10-15 US disclosed
US-20160351820-A1 ORGANIC COMPOUND, ORGANIC OPTOELECTRIC DIODE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-12-01 US disclosed
US-20160351820-A1 ORGANIC COMPOUND, ORGANIC OPTOELECTRIC DIODE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-12-01 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 (3 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-20190326517-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CYP1A1, CRY1, CYP1B1 ALOX5 675/4885AHR 102/4885PRKDC 4466/4885
US-10446760-B2 Organic compound, organic optoelectric diode, and display device OCIAD1, OXER1, OR10J3 ALOX5 527/4885AHR 3603/4885PRKDC 3447/4885
US-20160351820-A1 ORGANIC COMPOUND, ORGANIC OPTOELECTRIC DIODE, AND DISPLAY DEVICE OCIAD1, OXER1, OR10J3 ALOX5 527/4885AHR 3603/4885PRKDC 3447/4885

“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.