SCHEMBL17940746

SCHEMBL17940746

Cc1cc(C)cc(-n2cnc3c(C#N)cccc32)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.41
▸ ELANE P08246 1/20 0.41
▸ KMT2A Q03164 2/20 0.39
▸ GABRA1 P14867 3/20 0.38
▸ GABRG2 P18507 3/20 0.38
▸ GABRB3 P28472 3/20 0.38
▸ GABRA5 P31644 2/20 0.38
▸ GABRA3 P34903 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HCAR1 Q9BXC0 1/20 0.38
▸ CYP17A1 P05093 1/20 0.37
▸ FGFR1 P11362 1/20 0.37
▸ BCL6 P41182 1/20 0.36
▸ SRC P12931 1/20 0.36
▸ GRM2 Q14416 1/20 0.35
▸ GABRA2 P47869 2/20 0.35
▸ MEN1 O00255 1/20 0.35

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
SCHEMBL17940747 0.90 HPGD (0.48) HPGDELANEKMT2AGABRA1GABRG2
SCHEMBL17940689 0.87 CYP17A1 (0.39) ELANEGABRA1GABRG2GABRB3GABRA5
SCHEMBL17940726 0.83 HCAR1 (0.41) HPGDELANEGABRA1GABRG2GABRB3
SCHEMBL17940706 0.81 HTT (0.51) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL17940700 0.79 HCAR1 (0.43) HPGDKMT2AGABRA1GABRG2GABRB3
SCHEMBL21361137 0.78 FGFR1 (0.49) HPGDALDH1A1FGFR1SRC
SCHEMBL17940732 0.77 GABRA1 (0.49) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL17940741 0.77 PI4KA (0.46) HPGDELANEKMT2AGABRA1GABRG2
SCHEMBL6427934 0.74 IMPDH2 (0.43) ELANEKMT2AALDH1A1CYP17A1GRM2
SCHEMBL28252193 0.72 ALDH1A1 (0.44) HPGDKMT2AGABRA1GABRG2GABRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114933614-A Organic electroluminescent material and device 环球展览公司 2022-08-23 — — CN disclosed
CN-105820122-B Organic electroluminescent material and device 环球展览公司 2022-05-17 — — CN disclosed
US-10418569-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2019-09-17 — — US disclosed
US-10418569-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2019-09-17 — — US disclosed
US-20160218303-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2016-07-28 — — US disclosed
US-20160218303-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2016-07-28 — — US disclosed
US-20160218303-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2016-07-28 — — 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-10418569-B2 Organic electroluminescent materials and devices OCIAD2, OCIAD1, OSBP2 HPGD 1307/4885ELANE 586/4885KMT2A 3749/4885
US-20160218303-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, OSBP2 HPGD 1307/4885ELANE 586/4885KMT2A 3749/4885

“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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