SCHEMBL17952092

SCHEMBL17952092

Cc1cccc(C)c1N1c2c(C#N)ccc(C#N)c2N(C)[C@@H]1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.39
▸ KDM4E B2RXH2 4/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ HTR7 P34969 1/20 0.33
▸ USP2 O75604 1/20 0.32
▸ CLK1 P49759 1/20 0.32
▸ AR P10275 6/20 0.32
▸ CYP1A2 P05177 2/20 0.32
▸ CYP2C19 P33261 2/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ CASP1 P29466 2/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ CASP7 P55210 1/20 0.31
▸ RORC P51449 1/20 0.30
▸ LMNA P02545 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
SCHEMBL17952269 0.87 AR (0.35) TSHRKDM4EALDH1A1HTR1ADRD2
SCHEMBL17952333 0.86 NSD2 (0.32) TSHRKDM4EALDH1A1ARMAPT
SCHEMBL17952095 0.86 AR (0.34) TSHRKDM4EALDH1A1ARMAPT
SCHEMBL17952096 0.85 TSHR (0.35) TSHRKDM4EALDH1A1HTR1ADRD2
SCHEMBL17947662 0.85 TSHR (0.41) TSHRKDM4EALDH1A1HTR1ADRD2
SCHEMBL21361134 0.85 TSHR (0.41) TSHRKDM4EALDH1A1HTR1ADRD2
SCHEMBL17952388 0.85 TSHR (0.41) TSHRKDM4EALDH1A1ARCYP1A2
SCHEMBL17947666 0.84 AR (0.32) TSHRARNSD2
SCHEMBL17952342 0.84 HRH4 (0.33) AR
SCHEMBL17952345 0.83 AR (0.32) TSHRAR

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

“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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