SCHEMBL19797401

SCHEMBL19797401

CC1(C)c2ccccc2N(c2cccc(-c3ccnc(P(=O)(c4ccccc4)c4ccccc4)c3)c2)c2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.34
▸ FAAH O00519 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ MGLL Q99685 1/20 0.34
▸ ADAMTS5 Q9UNA0 1/20 0.33
▸ COMT P21964 4/20 0.31
▸ PGR P06401 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ THPO P40225 1/20 0.31
▸ BTK Q06187 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
SCHEMBL19797405 0.89 FAAH (0.33) ALDH1A1FAAHHSP90AA1PKMHTT
SCHEMBL19805129 0.85 GRM5 (0.33) PGR
SCHEMBL13833016 0.85 ALDH1A1 (0.42) ALDH1A1FAAHHSP90AA1PKMHTT
SCHEMBL19797409 0.84 NPSR1 (0.32) —
SCHEMBL19797404 0.84 ALDH1A1 (0.33) ALDH1A1FAAHHSP90AA1PKMHTT
SCHEMBL19797402 0.83 ADAMTS5 (0.33) ALDH1A1FAAHHSP90AA1PKMHTT
SCHEMBL19797403 0.81 ALDH1A1 (0.37) ALDH1A1FAAHHSP90AA1PKMHTT
SCHEMBL19797372 0.79 PGR (0.33) ALDH1A1PGRCYP1A2CYP3A4CYP2D6
SCHEMBL19797414 0.79 ITGB2 (0.33) ALDH1A1HTTCYP1A2CYP3A4CYP2D6
SCHEMBL19805153 0.78 KCNN4 (0.36) PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10388889-B2 Substituted phosphines as components of organic light-emitting devices SAMSUNG DISPLAY CO., LTD. (KR) 2019-08-20 — — US disclosed
US-20180026206-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-01-25 — — US disclosed
US-20180026206-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-01-25 — — 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-20180026206-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CYP1A1, CYP1B1 ALDH1A1 24/4885FAAH 831/4885HSP90AA1 4440/4885
US-10388889-B2 Substituted phosphines as components of organic light-emitting devices CRY1, CRY2, PER2 ALDH1A1 364/4885FAAH 3062/4885HSP90AA1 4658/4885

“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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