SCHEMBL3325166

SCHEMBL3325166

CC(=O)C(O)C(O)c1ccc(-c2nc3ccccc3o2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.59
NPC1 O15118 7/20 0.59
KDM4E B2RXH2 5/20 0.55
ALDH1A1 P00352 4/20 0.55
HPGD P15428 4/20 0.55
MAPT P10636 4/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
HSD17B10 Q99714 3/20 0.55
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
ATM Q13315 1/20 0.51
BCHE P06276 3/20 0.49
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
MMP8 P22894 1/20 0.49
MMP13 P45452 1/20 0.49
TP53 P04637 1/20 0.48
GAA P10253 2/20 0.46
GLA P06280 1/20 0.46
NFKB1 P19838 1/20 0.46

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
SCHEMBL12852111 1.00 RAB9A (0.59) RAB9ANPC1KDM4EALDH1A1HPGD
SCHEMBL3325893 0.85 NPC1 (0.50) RAB9ANPC1KDM4EALDH1A1HPGD
SCHEMBL21544993 0.83 NPC1 (0.56) RAB9ANPC1KDM4EALDH1A1HPGD
SCHEMBL11695483 0.78 MAOA (0.65) RAB9ANPC1KDM4EALDH1A1HPGD
2-Phenylbenzo[D]Oxazole SCHEMBL5462415 0.78 RAB9A (0.68) RAB9ANPC1KDM4EALDH1A1HPGD
SCHEMBL9680824 0.77 NPC1 (0.72) RAB9ANPC1KDM4EALDH1A1HPGD
SCHEMBL1102401 0.77 NPC1 (0.68) RAB9ANPC1KDM4EALDH1A1HPGD
SCHEMBL31170 0.76 NPC1 (0.81) RAB9ANPC1KDM4EALDH1A1HPGD
Acetic Acid SCHEMBL9820144 0.75 RAB9A (0.64) RAB9ANPC1KDM4EALDH1A1HPGD
SCHEMBL24250386 0.75 NPC1 (0.59) RAB9ANPC1KDM4EALDH1A1HPGD

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
EP-2121611-B1 UV-filter compounds based on alpha,beta-dihydroxyketones DSM IP ASSETS BV (NL) 2015-04-15 EP disclosed
US-8278459-B2 UV-filter compounds DSM IP ASSETS B.V. (NL) 2012-10-02 US disclosed
US-20100119462-A1 UV-FILTER COMPOUNDS DSM IP ASSETS B.V. (NL) 2010-05-13 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-20100119462-A1 UV-FILTER COMPOUNDS ERCC4, ERCC5, ERCC1 RAB9A 1640/4885NPC1 2100/4885KDM4E 1538/4885

“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.