SCHEMBL5824031

SCHEMBL5824031

O=C(OC1=CCCCC1)c1ccccc1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.51
HPGD P15428 4/20 0.51
ALOX15 P16050 1/20 0.51
KDM4E B2RXH2 4/20 0.51
ALDH1A1 P00352 3/20 0.51
TSHR P16473 2/20 0.46
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 3/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 3/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
ACMSD Q8TDX5 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
HMGB1 P09429 1/20 0.39
CA4 P22748 1/20 0.39

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
SCHEMBL8140023 0.90 KDM4E (0.39) HSD17B10HPGDALOX15KDM4EALDH1A1
SCHEMBL20503234 0.83 KMT2A (0.47) ALDH1A1LMNANPC1RAB9AKMT2A
SCHEMBL444989 0.83 ALDH1A1 (0.47) HSD17B10HPGDKDM4EALDH1A1TSHR
SCHEMBL6353529 0.79 KMT2A (0.51) HSD17B10ALOX15ALDH1A1TSHRLMNA
SCHEMBL8138563 0.76 KMT2A (0.39) HPGDALDH1A1LMNANPC1RAB9A
SCHEMBL8132876 0.74 MAPK1 (0.41) HPGDKDM4EALDH1A1LMNANPC1
SCHEMBL10663480 0.74 ALDH1A1 (0.33) HSD17B10HPGDKDM4EALDH1A1TSHR
SCHEMBL14369221 0.74 HPGD (0.50) HSD17B10HPGDALOX15KDM4EALDH1A1
SCHEMBL9341204 0.73 KMT2A (0.49) ALDH1A1TSHRLMNATDP1KMT2A
SCHEMBL9011880 0.73 HDAC2 (0.48) HSD17B10ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2006124444-A PERFUMERY COMPOSITION RESISTANT TO RUNNING WATER, AND COSMETIC SODA AROMATIC CO LTD 2006-05-18 JP disclosed
US-20050032672-A1 Fragrance compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. 2005-02-10 US disclosed
EP-1505055-A1 Fragrance compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2005-02-09 EP 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-20050032672-A1 Fragrance compositions SUCLG1, CUTA, COL14A1 HSD17B10 1309/4885HPGD 555/4885ALOX15 93/4885

“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.