SCHEMBL23911698

SCHEMBL23911698

O=P(c1ccccc1)(c1cccnc1)N1c2ccccc2C(c2ccccc2)(c2ccccc2)c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KCNA5 P22460 10/20 0.40
▸ KCNN4 O15554 7/20 0.38
▸ ALDH1A1 P00352 2/20 0.32
▸ LMNA P02545 3/20 0.32
▸ GAA P10253 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ CYP19A1 P11511 1/20 0.31
▸ CYP2D6 P10635 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ TSHR P16473 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
SCHEMBL23911696 0.86 LMNA (0.43) KCNA5KCNN4LMNAGAAKMT2A
SCHEMBL23911731 0.75 LMNA (0.36) ALDH1A1LMNAGAAKMT2AMAPT
SCHEMBL23911733 0.72 LMNA (0.44) KCNA5KCNN4LMNAGAAKMT2A
SCHEMBL23911740 0.69 LMNA (0.33) ALDH1A1LMNAGAAKMT2AMAPT
SCHEMBL19721596 0.69 ALDH1A1 (0.43) ALDH1A1LMNAKMT2AMAPTHTT
SCHEMBL23911734 0.68 LMNA (0.40) KCNA5KCNN4ALDH1A1LMNAGAA
SCHEMBL23911738 0.67 LMNA (0.41) KCNA5KCNN4ALDH1A1LMNAGAA
SCHEMBL25310546 0.66 LMNA (0.51) ALDH1A1LMNAGAAMAPTHTT
SCHEMBL22160113 0.65 ALDH1A1 (0.42) ALDH1A1CYP19A1CYP2D6CYP2C9
SCHEMBL29892532 0.65 ALDH1A1 (0.42) ALDH1A1CYP19A1CYP2D6CYP2C9

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-20220020937-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2022-01-20 — — US disclosed
US-11145823-B2 Heterocyclic compound and organic light emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2021-10-12 — — 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-11145823-B2 Heterocyclic compound and organic light emitting device including the same TRPC1, ODC1, DDT KCNA5 773/4885KCNN4 126/4885ALDH1A1 48/4885
US-20220020937-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME TRPC1, ODC1, DDT KCNA5 578/4885KCNN4 79/4885ALDH1A1 63/4885

“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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