SCHEMBL4958730

SCHEMBL4958730

O=C(O)c1c(O)ccc2ccccc12.[Al]

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.59
HSD17B10 Q99714 3/20 0.59
KDM4E B2RXH2 3/20 0.59
GLA P06280 2/20 0.59
HPGD P15428 2/20 0.59
CYP1A2 P05177 2/20 0.59
CYP2C19 P33261 2/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
ABCG2 Q9UNQ0 2/20 0.58
LDHA P00338 1/20 0.53
GAA P10253 1/20 0.53
PTPN22 Q9Y2R2 1/20 0.52
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
WDR5 P61964 1/20 0.50

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
SCHEMBL29376732 0.98 ALDH1A1 (0.61) ALDH1A1HSD17B10KDM4EGLAHPGD
SCHEMBL29593799 0.98 ALDH1A1 (0.61) ALDH1A1HSD17B10KDM4EGLAHPGD
SCHEMBL4268 0.98 ALDH1A1 (0.61) ALDH1A1HSD17B10KDM4EGLAHPGD
Calcium SCHEMBL4962060 0.96 ALDH1A1 (0.59) ALDH1A1HSD17B10KDM4EGLAHPGD
Bromide SCHEMBL7537985 0.96 ALDH1A1 (0.59) ALDH1A1HSD17B10KDM4EGLAHPGD
Hydrochloric Acid SCHEMBL526822 0.96 ALDH1A1 (0.59) ALDH1A1HSD17B10KDM4EGLAHPGD
Iodide SCHEMBL6334465 0.96 ALDH1A1 (0.59) ALDH1A1HSD17B10KDM4EGLAHPGD
Water SCHEMBL8971546 0.96 ALDH1A1 (0.59) ALDH1A1HSD17B10KDM4EGLAHPGD
Ammonia Solution, Strong SCHEMBL9297223 0.96 ALDH1A1 (0.59) ALDH1A1HSD17B10KDM4EGLAHPGD
SCHEMBL4959080 0.96 ALDH1A1 (0.59) ALDH1A1HSD17B10KDM4EGLAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102131507-B Film preparation containing loperamide hydrochloride KYUKYU YAKUHIN KOGYO KK 2015-06-10 CN disclosed
EP-1871844-B1 BUBBLE COMPOSITION WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2014-08-27 EP disclosed
CN-102131507-A Film preparation containing loperamide hydrochloride KYUKYU YAKUHIN KOGYO KK 2011-07-20 CN disclosed
CN-101518642-B Liquid preparation for oral administration SS PHARMACEUTICAL CO 2010-07-14 CN disclosed
CN-101543480-A Tablets KOWA CO 2009-09-30 CN disclosed
CN-101518642-A Liquid preparation for oral administration SS PHARMACEUTICAL CO (JP) 2009-09-02 CN disclosed
EP-1871844-A2 NOVELTY COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C Technologies LLC (US) 2008-01-02 EP disclosed
US-20060236470-A1 Novelty compositions with color changing indicator CRAYOLA LLC 2006-10-26 US disclosed
WO-2006105191-A2 NOVELTY COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2006-10-05 WO disclosed
CN-1406625-A Liquid preparation for oral administration SS PHARMACEUTICAL CO (JP) 2003-04-02 CN disclosed
CN-1149832-A Solid antacid and process for producing the same YAMANOUCHI PHARMA CO LTD (JP) 1997-05-14 CN disclosed
US-5137864-A Foamed intermediate layer with minute voids which are fewer in lower portion, increasing in upper portion close to coloring layer RICOH COMPANY, LTD. (JP) 1992-08-11 US disclosed
US-5084593-A Cyanine, aniline dyes for heat sensitive recording elements RICOH COMPANY, LTD. (JP) 1992-01-28 US disclosed
US-5008238-A Thermosensitive material with phenolic developer RICOH COMPANY, LTD. (JP) 1991-04-16 US disclosed
US-4985345-A LEUCO DYES, BAR CODE READER RICOH COMPANY, LTD. (JP) 1991-01-15 US disclosed
US-4916111-A Thermosensitive recording material RICOH COMPANY, LTD. (JP) 1990-04-10 US disclosed
US-3934070-A Recording sheet and color developer therefor FUJI PHOTO FILM CO., LTD. (JA) 1976-01-20 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-20060236470-A1 Novelty compositions with color changing indicator MITF, CRABP2, SHH ALDH1A1 1689/4885HSD17B10 2416/4885KDM4E 3178/4885

“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.