SCHEMBL34468801

SCHEMBL34468801

CCC(CC)NC(=O)c1cc2ccccc2[nH]c1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 1/20 0.55
▸ SMYD3 Q9H7B4 3/20 0.54
▸ CCR1 P32246 1/20 0.50
▸ KDM4E B2RXH2 5/20 0.49
▸ TSHR P16473 4/20 0.49
▸ ALDH1A1 P00352 3/20 0.48
▸ HPGD P15428 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ TAS1R3 Q7RTX0 2/20 0.48
▸ TAS1R1 Q7RTX1 2/20 0.48
▸ HTT P42858 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.45
▸ BRD4 O60885 1/20 0.45
▸ DAO P14920 1/20 0.45
▸ DDO Q99489 1/20 0.45
▸ CNR2 P34972 1/20 0.45
▸ TAS1R2 Q8TE23 1/20 0.45
▸ GAA P10253 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ PADI4 Q9UM07 1/20 0.44

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
SCHEMBL34468764 0.88 SMYD3 (0.56) DRD2SMYD3CCR1KDM4ETSHR
SCHEMBL1440740 0.85 SMYD3 (0.57) DRD2SMYD3CCR1KDM4ETSHR
SCHEMBL34468783 0.83 HPGD (0.58) DRD2SMYD3CCR1KDM4ETSHR
SCHEMBL16627598 0.82 SMYD3 (0.54) DRD2SMYD3CCR1KDM4ETSHR
SCHEMBL34468797 0.80 KDM4E (0.62) SMYD3CCR1KDM4EALDH1A1HPGD
SCHEMBL34468812 0.80 KDM4E (0.62) SMYD3CCR1KDM4EALDH1A1HPGD
SCHEMBL34468866 0.80 KDM4E (0.62) SMYD3CCR1KDM4EALDH1A1HPGD
SCHEMBL19414710 0.80 SMYD3 (0.58) SMYD3CCR1KDM4ETSHRALDH1A1
SCHEMBL34468770 0.80 CCR1 (0.62) SMYD3CCR1KDM4ETSHRGAA
SCHEMBL16627858 0.80 DRD2 (0.58) DRD2SMYD3KDM4ETSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026090571-A1 APYRASE INHIBITORS TEXAS CROP SCIENCE, INC. (US) 2026-04-30 — — WO claimed
US-20260116873-A1 APYRASE INHIBITORS TEXAS CROP SCIENCE INC (US) 2026-04-30 — — US claimed
WO-2026090571-A1 APYRASE INHIBITORS TEXAS CROP SCIENCE, INC. (US) 2026-04-30 — — WO disclosed
US-20260116873-A1 APYRASE INHIBITORS TEXAS CROP SCIENCE INC (US) 2026-04-30 — — 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-20260116873-A1 APYRASE INHIBITORS APEH, AP3M1, SRR DRD2 1639/4885SMYD3 1625/4885CCR1 1113/4885

“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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