SCHEMBL25112872

SCHEMBL25112872

c1ccc2c(c1)c1ccccc1c1cc(-c3ccc(-c4cn5cccnc5n4)cc3)cc3ccc4cccc2c4c31

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 16/20 0.56
▸ KDM4E B2RXH2 15/20 0.56
▸ HPGD P15428 9/20 0.56
▸ GLA P06280 6/20 0.56
▸ HSD17B10 Q99714 4/20 0.56
▸ RAB9A P51151 13/20 0.53
▸ GAA P10253 9/20 0.53
▸ NPC1 O15118 9/20 0.53
▸ SMN1; SMN2 Q16637 7/20 0.53
▸ MAPT P10636 7/20 0.53
▸ KMT2A Q03164 5/20 0.53
▸ MEN1 O00255 4/20 0.53
▸ TP53 P04637 2/20 0.53
▸ POLB P06746 3/20 0.50
▸ GFER P55789 1/20 0.50
▸ CDC7 O00311 1/20 0.48
▸ DAPK3 O43293 1/20 0.48
▸ DYRK3 O43781 1/20 0.48
▸ ROCK2 O75116 1/20 0.48
▸ PRKD3 O94806 1/20 0.48

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
SCHEMBL25112781 0.95 ALDH1A1 (0.53) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL25112908 0.94 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL25112846 0.93 ALDH1A1 (0.53) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL25112861 0.91 ALDH1A1 (0.54) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL25112792 0.90 ALDH1A1 (0.47) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL25112864 0.84 ALDH1A1 (0.47) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL25112805 0.83 ALDH1A1 (0.52) ALDH1A1KDM4EHPGDGLAHSD17B10
SCHEMBL25112871 0.82 RAB9A (0.52) ALDH1A1KDM4EHPGDHSD17B10RAB9A
SCHEMBL25112923 0.82 RAB9A (0.52) ALDH1A1KDM4EHPGDHSD17B10RAB9A
SCHEMBL10353295 0.80 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDGLAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230085328-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-03-16 — — 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 (1 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-20230085328-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE L1CAM, PIEZO1, LEF1 ALDH1A1 192/4885KDM4E 1371/4885HPGD 3868/4885

“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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