SCHEMBL3600800

SCHEMBL3600800

CC(=O)Oc1c(C)cc(O)cc1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 3/20 0.55
▸ HTT P42858 2/20 0.55
▸ KDM4E B2RXH2 2/20 0.55
▸ TP53 P04637 1/20 0.55
▸ GAA P10253 1/20 0.55
▸ MAPT P10636 1/20 0.55
▸ PREP P48147 3/20 0.46
▸ CELA1 Q9UNI1 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ CYP3A4 P08684 6/20 0.44
▸ POLB P06746 1/20 0.43
▸ BACE1 P56817 2/20 0.42
▸ ACHE P22303 2/20 0.42
▸ ALOX15 P16050 2/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ MAOA P21397 1/20 0.41
▸ TBXA2R P21731 1/20 0.41
▸ ADRA1A P35348 1/20 0.41
▸ HTR2B P41595 1/20 0.41

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
SCHEMBL7921839 0.85 KDM4E (0.57) HSD17B10HTTKDM4ETP53GAA
SCHEMBL3156904 0.84 KDM4E (0.52) HSD17B10HTTKDM4ETP53GAA
SCHEMBL5042710 0.83 HTT (0.45) HSD17B10HTTKDM4ETP53GAA
SCHEMBL6764077 0.83 HTT (0.45) HSD17B10HTTKDM4ETP53GAA
SCHEMBL23809728 0.82 BACE1 (0.52) HSD17B10HTTKDM4ETP53GAA
SCHEMBL12521523 0.81 CA1 (0.56) HSD17B10HTTKDM4ETP53GAA
SCHEMBL7384263 0.80 KDM4E (0.49) HSD17B10HTTKDM4ETP53GAA
SCHEMBL10790928 0.80 HTT (0.49) HSD17B10HTTKDM4ETP53GAA
SCHEMBL9042745 0.80 KDM4E (0.49) HSD17B10HTTKDM4ETP53GAA
SCHEMBL12299731 0.80 KDM4E (0.49) HSD17B10HTTKDM4ETP53GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2462124-B9 MESOIONIC PESTICIDES DU PONT (US) 2017-08-23 — — EP disclosed
EP-1637527-B1 CANNABINOID RECEPTOR MODULATOR TAKEDA PHARMACEUTICAL (JP) 2013-04-17 — — EP disclosed
US-20100240743-A1 CANNABINOID RECEPTOR MODULATOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-23 — — US disclosed
US-7507841-B2 Carbamoylamino-substituted 2,3-dihydro-benzofurans, indoles and benzothiophenes, e.g., (+)-N-((3R)-3-(4-isopropylphenyl)-4,6,7-trimethyl-2,3-dihydro-1-benzofuran-5-yl)-3,3-dimethylbutanamide; cerebrovascular disorders TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-03-24 — — US disclosed
US-20090023800-A1 Cannabinoid receptor modulator TAKEDA PHARMACEUTICAL COMPANY LIMITED 2009-01-22 — — US disclosed
US-7465815-B2 Cannabinoid receptor modulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-16 — — US disclosed
US-20080021087-A1 Cannabinoid receptor modulator TAKEDA PHARMACEUTICAL COMPANY LIMITED 2008-01-24 — — US disclosed
US-20070099990-A1 Cannabinoid receptor modulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-05-03 — — US disclosed
EP-1637527-A1 CANNABINOID RECEPTOR MODULATOR Takeda Pharmaceutical Company Limited (JP) 2006-03-22 — — EP disclosed
EP-0891974-B1 Process for producing chromans KURARAY CO (JP) 2002-04-17 — — EP disclosed
US-6262078-B1 Phenoxymethyl piperidine derivatives for the treatment of neuropathic pain SYNTEX (U.S.A.) LLC 2001-07-17 — — US disclosed
US-6133471-A Process for producing chromans KURARAY CO., LTD. (JP) 2000-10-17 — — US disclosed
US-6130341-A Process for producing chromans KURARAY CO., LTD. (JP) 2000-10-10 — — US disclosed
US-6110937-A A SODIUM CHANNEL BLOCKER TREATING AS LOCAL ANESTHETICS AND IN THE TREATMENT OF CARDIAC ARRHYTHMIAS SYNTEX USA, INC. (US) 2000-08-29 — — US disclosed
EP-0891974-A1 Process for producing chromans KURARAY CO., LTD. (JP) 1999-01-20 — — EP disclosed
EP-0869119-A1 Phenoxymethyl piperidine derivatives being sodium channle blockers F. HOFFMANN-LA ROCHE AG (CH) 1998-10-07 — — 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 (4 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-20100240743-A1 CANNABINOID RECEPTOR MODULATOR CNR1, CNR2, GPR18 HSD17B10 727/4885HTT 4582/4885KDM4E 737/4885
US-20080021087-A1 Cannabinoid receptor modulator CNR1, CNR2, GPR18 HSD17B10 727/4885HTT 4582/4885KDM4E 737/4885
US-20090023800-A1 Cannabinoid receptor modulator CNR1, CNR2, GPR18 HSD17B10 727/4885HTT 4582/4885KDM4E 737/4885
US-20070099990-A1 Cannabinoid receptor modulator CNR1, CNR2, GPR18 HSD17B10 727/4885HTT 4582/4885KDM4E 737/4885

“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.

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