SCHEMBL29873266

SCHEMBL29873266

COc1ccc(CN(Cc2ccc(OC)cc2)c2nn(Cc3ccc(OC)cc3)c3ncc([N+](=O)[O-])cc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ KAT2B Q92831 1/20 0.44
▸ CNR2 P34972 3/20 0.42
▸ ACHE P22303 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ CNR1 P21554 1/20 0.42
▸ SLC29A1 Q99808 1/20 0.40
▸ PDE1B Q01064 1/20 0.39
▸ PDE5A O76074 1/20 0.39
▸ EGFR P00533 1/20 0.38
▸ IGF1R P08069 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ CRHBP P24387 1/20 0.38
▸ CRHR2 Q13324 1/20 0.38

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
SCHEMBL29873567 0.87 MAPT (0.44) MAPTSMN1; SMN2CNR2ACHEKMT2A
SCHEMBL1593005 0.83 MAPT (0.51) MAPTSMN1; SMN2KAT2BCNR2ACHE
SCHEMBL29872415 0.82 PDE1B (0.40) MAPTSMN1; SMN2CNR2CNR1PDE1B
SCHEMBL1593522 0.80 CNR2 (0.50) MAPTSMN1; SMN2KAT2BCNR2ACHE
SCHEMBL25227436 0.77 KMT2A (0.49) MAPTSMN1; SMN2KAT2BCNR2KMT2A
SCHEMBL30473818 0.77 KMT2A (0.49) MAPTSMN1; SMN2KAT2BCNR2KMT2A
SCHEMBL1593950 0.76 CNR2 (0.56) MAPTSMN1; SMN2KAT2BCNR2ACHE
SCHEMBL29872467 0.76 ALDH1A1 (0.46) MAPTSMN1; SMN2KMT2APDE1BPDE5A
SCHEMBL15556714 0.74 MAPT (0.47) MAPTSMN1; SMN2NPC1RAB9APDE1B
SCHEMBL23069180 0.74 MAPT (0.50) MAPTSMN1; SMN2CNR2ACHEKMT2A

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-20220306640-A1 HYDANTOIN DERIVATIVE ONO PHARMACEUTICAL CO., LTD. (JP) 2022-09-29 — — 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-20220306640-A1 HYDANTOIN DERIVATIVE DDR1, DDR2, DDRGK1 MAPT 3943/4885SMN1; SMN2 1226/4885KAT2B 2326/4885

“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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