SCHEMBL7612604

SCHEMBL7612604

C1=CCC2Oc3ccccc3NC2=C1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.40
CREBBP Q92793 1/20 0.40
PARP1 P09874 1/20 0.39
ALOX5 P09917 1/20 0.37
NISCH Q9Y2I1 2/20 0.36
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
GAA P10253 1/20 0.31

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
SCHEMBL18587038 0.69 PARP1 (0.40) BRD4CREBBPPARP1ALOX5ALDH1A1
SCHEMBL23299454 0.69 MAOB (0.31)
SCHEMBL10064030 0.68 ALDH1A1 (0.33) ALDH1A1
SCHEMBL1011491 0.68 CREBBP (0.39) BRD4CREBBP
SCHEMBL24489433 0.68 NISCH (0.33) NISCHALDH1A1
SCHEMBL12194864 0.68 MAOB (0.41) NISCHALDH1A1
SCHEMBL25829886 0.66 ALDH1A1 (0.43) BRD4CREBBPALDH1A1HPGDGAA
SCHEMBL18403517 0.66 MAOB (0.38) NISCH
SCHEMBL15969613 0.61 MEN1 (0.41) BRD4CREBBPALOX5GAA
SCHEMBL11828996 0.61 BRD4 (0.62) BRD4CREBBPPARP1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10934248-B2 Light-emitting material, organic light-emitting device, and compound KYULUX, INC. (JP) 2021-03-02 US disclosed
EP-3093326-B1 LIGHT-EMITTING MATERIAL, ORGANIC LIGHT-EMITTING ELEMENT, AND COMPOUND KYULUX INC (JP) 2020-03-18 EP disclosed
US-20190345095-A1 LIGHT-EMITTING MATERIAL, ORGANIC LIGHT-EMITTING DEVICE, AND COMPOUND KYULUX, INC. (JP) 2019-11-14 US disclosed
US-10381573-B2 Light-emitting material, organic light-emitting device, and compound KYULUX, INC. (JP) 2019-08-13 US disclosed
US-20160380205-A1 LIGHT-EMITTING MATERIAL, ORGANIC LIGHT-EMITTING DEVICE, AND COMPOUND KYULUX, INC. (JP) 2016-12-29 US disclosed
EP-3093326-A1 LIGHT-EMITTING MATERIAL, ORGANIC LIGHT-EMITTING ELEMENT, AND COMPOUND Kyulux, Inc. (JP) 2016-11-16 EP disclosed
EP-1265886-A2 CARBOCYCLIC SIDE CHAIN CONTAINING, N-SUBSTITUTED METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2002-12-18 EP disclosed
WO-2001070720-A2 CARBOCYCLIC SIDE CHAIN CONTAINING, N-SUBSTITUTED METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2001-09-27 WO 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 (4 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-20190345095-A1 LIGHT-EMITTING MATERIAL, ORGANIC LIGHT-EMITTING DEVICE, AND COMPOUND CRY2, NR2E3, CRY1 BRD4 2057/4885CREBBP 3965/4885PARP1 1916/4885
US-10381573-B2 Light-emitting material, organic light-emitting device, and compound CRY1, CRY2, GLB1 BRD4 2787/4885CREBBP 3871/4885PARP1 1321/4885
US-10934248-B2 Light-emitting material, organic light-emitting device, and compound CRY2, NR2E3, CRY1 BRD4 2057/4885CREBBP 3965/4885PARP1 1916/4885
US-20160380205-A1 LIGHT-EMITTING MATERIAL, ORGANIC LIGHT-EMITTING DEVICE, AND COMPOUND CRY1, CRY2, GLB1 BRD4 2805/4885CREBBP 3867/4885PARP1 1306/4885

“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.