SCHEMBL17952187

SCHEMBL17952187

Cc1cc(C)c(C)c(N2c3cc(C#N)c(C#N)cc3N(C)[C@@H]2C)c1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ TSHR P16473 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ ALOX15 P16050 2/20 0.33
▸ CASP1 P29466 2/20 0.33
▸ CASP7 P55210 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ TAAR1 Q96RJ0 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MAOA P21397 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ POLB P06746 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL17952261 0.87 MEN1 (0.30) KDM4EALDH1A1ALOX15CASP1CASP7
SCHEMBL17952275 0.87 KDM4E (0.35) KDM4EALDH1A1TSHRHPGDSMN1; SMN2
SCHEMBL26971707 0.84 — —
SCHEMBL17952212 0.84 KDM4E (0.36) KDM4EALDH1A1TSHRHPGDALOX15
SCHEMBL17952622 0.84 NPSR1 (0.36) KDM4EALDH1A1TSHRHPGDSMN1; SMN2
SCHEMBL17952324 0.84 MEN1 (0.30) KMT2A
SCHEMBL17952317 0.84 MEN1 (0.32) CASP1TDP1MAPTMAOAMAOB
SCHEMBL17952376 0.83 CASP3 (0.35) KDM4EALDH1A1HPGD
SCHEMBL17952329 0.82 — —
SCHEMBL17952240 0.82 — —

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-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

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 KDM4E 4426/4885ALDH1A1 1620/4885TSHR 4400/4885
US-20160218303-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, OSBP2 KDM4E 4426/4885ALDH1A1 1620/4885TSHR 4400/4885

“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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