SCHEMBL2445516

SCHEMBL2445516

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nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 5/20 0.42
ALDH1A1 P00352 2/20 0.42
TSHR P16473 2/20 0.39
SRC P12931 1/20 0.32
SQLE Q14534 1/20 0.31
USP2 O75604 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL3898616 1.00 ALOX15 (0.42) ALOX15ALDH1A1TSHRSRCSQLE
SCHEMBL3901659 0.81 ALOX15 (0.40) ALOX15ALDH1A1TSHRSRC
SCHEMBL3909207 0.80 ALOX15 (0.39) ALOX15ALDH1A1TSHR
SCHEMBL3901906 0.78 ALOX15 (0.37) ALOX15ALDH1A1TSHRUSP2
SCHEMBL3904245 0.78 ALOX15 (0.37) ALOX15ALDH1A1TSHR
SCHEMBL3897147 0.78 ALOX15 (0.37) ALOX15ALDH1A1TSHR
SCHEMBL580621 0.77 ALOX15 (0.31) ALOX15ALDH1A1TSHR
SCHEMBL17335748 0.75 ALOX15 (0.48) ALOX15ALDH1A1TSHRSRCUSP2
SCHEMBL3904740 0.74 GLA (0.38) ALOX15ALDH1A1TSHRTDP1
SCHEMBL22445206 0.73 KMT2A (0.44) ALOX15ALDH1A1SQLE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2362765-A2 PERFUME SYSTEMS The Procter & Gamble Company (US) 2011-09-07 EP claimed
WO-2010065446-A2 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY (US) 2010-06-10 WO claimed
US-20100137178-A1 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY 2010-06-03 US claimed
EP-2362765-B1 PERFUME SYSTEMS PROCTER & GAMBLE (US) 2020-04-08 EP disclosed
US-8431520-B2 Perfume systems THE PROCTER & GAMBLE COMPANY (US) 2013-04-30 US disclosed
US-20130012422-A1 PERFUME SYSTEMS SMETS JOHAN (BE) 2013-01-10 US disclosed
US-20100137178-A1 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY 2010-06-03 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-20130012422-A1 PERFUME SYSTEMS TRPA1, PORCN, PLIN5 ALOX15 544/4885ALDH1A1 1194/4885TSHR 4772/4885
US-20100137178-A1 PERFUME SYSTEMS TRPA1, PORCN, PLIN5 ALOX15 544/4885ALDH1A1 1194/4885TSHR 4772/4885

“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.