SCHEMBL14029480

SCHEMBL14029480

CN1C[C@@H](CO)C=C2c3cccc4[nH]cc(c34)CC21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 7/20 1.00
KDM4E B2RXH2 6/20 1.00
ALDH1A1 P00352 6/20 1.00
MEN1 O00255 6/20 1.00
KMT2A Q03164 6/20 1.00
CYP2D6 P10635 6/20 1.00
MAPT P10636 5/20 1.00
CYP3A4 P08684 4/20 1.00
HPGD P15428 4/20 1.00
HIF1A Q16665 3/20 1.00
USP2 O75604 2/20 1.00
CYP1A2 P05177 2/20 1.00
GAA P10253 1/20 1.00
TAAR1 Q96RJ0 1/20 1.00
RECQL P46063 3/20 0.66
PLEC Q15149 1/20 0.66
DRD3 P35462 7/20 0.64
DRD2 P14416 6/20 0.64
HTR2B P41595 6/20 0.64
HTR6 P50406 6/20 0.64

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
SCHEMBL178071 1.00 HSD17B10 (1.00) HSD17B10KDM4EALDH1A1MEN1KMT2A
SCHEMBL30278505 1.00 HSD17B10 (1.00) HSD17B10KDM4EALDH1A1MEN1KMT2A
SCHEMBL10471429 1.00 HSD17B10 (1.00) HSD17B10KDM4EALDH1A1MEN1KMT2A
SCHEMBL25042463 1.00 HSD17B10 (1.00) HSD17B10KDM4EALDH1A1MEN1KMT2A
SCHEMBL7176983 1.00 HSD17B10 (1.00) HSD17B10KDM4EALDH1A1MEN1KMT2A
SCHEMBL25042462 1.00 HSD17B10 (1.00) HSD17B10KDM4EALDH1A1MEN1KMT2A
SCHEMBL9820435 1.00 HSD17B10 (1.00) HSD17B10KDM4EALDH1A1MEN1KMT2A
SCHEMBL25042461 1.00 HSD17B10 (1.00) HSD17B10KDM4EALDH1A1MEN1KMT2A
SCHEMBL257961 1.00 HSD17B10 (1.00) HSD17B10KDM4EALDH1A1MEN1KMT2A
Methyl Alcohol SCHEMBL27814674 0.99 HSD17B10 (0.98) HSD17B10KDM4EALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080267948-A1 Croos-B Structure Binding Compounds CROSSBETA BIOSCIENCES B.V. (NL) 2008-10-30 US disclosed
US-20080267948-A1 Croos-B Structure Binding Compounds CROSSBETA BIOSCIENCES B.V. (NL) 2008-10-30 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-20080267948-A1 Croos-B Structure Binding Compounds CACYBP, TBCB, MYCBP HSD17B10 982/4885KDM4E 4553/4885ALDH1A1 3494/4885

“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.