SCHEMBL26343229

SCHEMBL26343229

C=C(C)CCc1cccc(P)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.37
▸ LPL P06858 2/20 0.34
▸ LIPG Q9Y5X9 2/20 0.34
▸ NOS1 P29475 1/20 0.34
▸ TAAR1 Q96RJ0 3/20 0.33
▸ PTPRB P23467 1/20 0.33
▸ CDC25A P30304 1/20 0.33
▸ CDC25B P30305 1/20 0.33
▸ PTEN P60484 1/20 0.33
▸ PTPMT1 Q8WUK0 1/20 0.33
▸ CHRM2 P08172 1/20 0.33
▸ CHRM1 P11229 1/20 0.33
▸ CHRM3 P20309 1/20 0.33
▸ MTNR1A P48039 1/20 0.33
▸ MTNR1B P49286 1/20 0.33
▸ FFAR1 O14842 1/20 0.33

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
SCHEMBL1554681 0.86 ALDH1A1 (0.43) ALDH1A1LPLLIPGNOS1TAAR1
SCHEMBL10907937 0.79 DRD2 (0.55) TAAR1CHRM2CHRM1CHRM3
SCHEMBL16335062 0.78 HTR3E (0.54) ALDH1A1TAAR1CHRM2CHRM1CHRM3
SCHEMBL16335080 0.78 TAAR1 (0.53) TAAR1FFAR1
SCHEMBL20459850 0.78 MAOA (0.55) ALDH1A1NOS1FFAR1
SCHEMBL2163306 0.76 ALDH1A1 (0.61) ALDH1A1FFAR1
SCHEMBL16334824 0.75 LPL (0.63) ALDH1A1LPLLIPG
SCHEMBL31539919 0.75 LPL (0.49) LPLLIPG
SCHEMBL13305509 0.74 CAPN1 (0.44) ALDH1A1NOS1PTPRBCDC25ACDC25B
SCHEMBL23009449 0.74 FFAR1 (0.48) FFAR1

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-20230303493-A1 ANTIBACTERIAL ADJUVANTS AND APPLICATIONS THEREOF SAN JOSE STATE UNIVERSITY RESEARCH FOUNDATION 2023-09-28 — — 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-20230303493-A1 ANTIBACTERIAL ADJUVANTS AND APPLICATIONS THEREOF CAPG, SLC11A2, CAPRIN1 ALDH1A1 4657/4885LPL 1981/4885LIPG 2207/4885

“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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