SCHEMBL691833

SCHEMBL691833

CC1COc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 1/20 0.43
LTB4R2 Q9NPC1 1/20 0.43
HCRTR2 O43614 1/20 0.41
DRD2 P14416 1/20 0.40
DRD3 P35462 1/20 0.40
TOP2A P11388 1/20 0.40
SLC6A2 P23975 7/20 0.40
CYP2D6 P10635 6/20 0.40
SLC6A4 P31645 6/20 0.40
CYP19A1 P11511 2/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
ITGB2 P05107 1/20 0.39
ICAM1 P05362 1/20 0.39
ITGAL P20701 1/20 0.39
SLC6A3 Q01959 2/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL10820255 1.00 LTB4R (0.43) LTB4RLTB4R2HCRTR2DRD2DRD3
SCHEMBL18570198 1.00 LTB4R (0.43) LTB4RLTB4R2HCRTR2DRD2DRD3
SCHEMBL13117931 1.00 LTB4R (0.43) LTB4RLTB4R2HCRTR2DRD2DRD3
SCHEMBL29259098 0.82 CYP2D6 (0.51) SLC6A2CYP2D6SLC6A4CYP19A1SLC6A3
SCHEMBL12216729 0.78 ABCB1 (0.42) LTB4RLTB4R2HCRTR2DRD2DRD3
SCHEMBL12727583 0.78 ITGB2 (0.46) ABCG2ITGB2ICAM1ITGAL
SCHEMBL2739937 0.78 ABCB1 (0.42) LTB4RLTB4R2HCRTR2DRD2DRD3
SCHEMBL2616050 0.78 ITGB2 (0.46) ABCG2ITGB2ICAM1ITGAL
SCHEMBL30388151 0.78 ITGB2 (0.46) ABCG2ITGB2ICAM1ITGAL
SCHEMBL13117930 0.78 ITGB2 (0.46) ABCG2ITGB2ICAM1ITGAL

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 208 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SUNOVION PHARMACEUTICALS INC. (US) 2021-11-30 US claimed
US-10693080-B2 Solvent for producing organic transistor DAICEL CORPORATION (JP) 2020-06-23 US claimed
CN-105659404-B Solvent for manufacturing organic transistor 株式会社大赛璐 2020-02-07 CN claimed
US-20190194163-A1 DUAL NAV1.2/5HT2a INHIBITORS FOR TREATING CNS DISORDERS SUNOVION PHARMACEUTICALS INC. (US) 2019-06-27 US claimed
WO-2018026371-A1 DUAL NAV1.2/5HT2A INHIBITORS FOR TREATING CNS DISORDERS SUNOVION PHARMACEUTICALS INC. (US) 2018-02-08 WO claimed
US-20160293849-A1 SOLVENT FOR PRODUCING ORGANIC TRANSISTOR DAICEL CORPORATION (JP) 2016-10-06 US claimed
CN-105659404-A Solvent for producing organic transistor 株式会社大赛璐 2016-06-08 CN claimed
EP-0147044-B1 BENZOFURANCARBOXAMIDES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM ADRIA LABORATORIES INC. (US) 1990-04-25 EP claimed
US-4888353-A Carboxamides useful as antiemetic or antipsychotic agents ERBAMONT, INC. (US) 1989-12-19 US claimed
WO-2023239750-A1 BICYCLIC-SUBSTITUTED GLUTARIMIDE CEREBLON BINDERS C4 THERAPEUTICS, INC. (US) 2023-12-14 WO disclosed
US-20230339902-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 C4 THERAPEUTICS, INC. (US) 2023-10-26 US disclosed
EP-3826723-B1 BORONIC ACID DERIVATIVES MERCK PATENT GMBH (DE) 2023-10-18 EP disclosed
WO-2023183613-A2 INDOLIZINE COMPOUNDS FOR THE TREATMENT OF MENTAL DISORDERS OR INFLAMMATION TACTOGEN INC (US) 2023-09-28 WO disclosed
US-20230303552-A1 ARYLSULFONYL DERIVATIVES AND THEIR USE AS MUSCARINIC ACETYLCHOLINE RECEPTOR M5 INHIBITORS VANDERBILT UNIVERSITY 2023-09-28 US disclosed
US-20070003680-A1 Bis-aromatic amides and their uses as sweet flavor modifiers, tastants, and taste enhancers SENOMYX, INC. 2007-01-04 US disclosed
US-20060258627-A1 Resistance-repellent retroviral protease inhibitors SEQUOIA PHARMACEUTICALS (US) 2006-11-16 US disclosed
US-20050267074-A1 Resistance-repellent retroviral protease inhibitors SEQUOIA PHARMACEUTICALS (US) 2005-12-01 US disclosed
WO-2005110428-A2 RESISTANCE-REPELLENT RETROVIRAL PROTEASE INHIBITORS SEQUOIA PHARMACEUTICALS, INC. (US) 2005-11-24 WO disclosed
WO-2005110428-A2 RESISTANCE-REPELLENT RETROVIRAL PROTEASE INHIBITORS SEQUOIA PHARMACEUTICALS, INC. (US) 2005-11-24 WO disclosed
EP-1044985-A1 ERYTHROMYCIN DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 2000-10-18 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 (8 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-20160293849-A1 SOLVENT FOR PRODUCING ORGANIC TRANSISTOR SCO2, SLCO2A1, OXSR1 LTB4R 256/4885LTB4R2 486/4885HCRTR2 1436/4885
US-20230339902-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 IKZF1, IKZF3, IKZF2 LTB4R 4062/4885LTB4R2 4129/4885HCRTR2 4016/4885
US-20190194163-A1 DUAL NAV1.2/5HT2a INHIBITORS FOR TREATING CNS DISORDERS SCN2A, HTR2A, HTR2C LTB4R 3955/4885LTB4R2 2763/4885HCRTR2 70/4885
US-20050267074-A1 Resistance-repellent retroviral protease inhibitors SERPINB1, MMP7, MME LTB4R 2842/4885LTB4R2 3632/4885HCRTR2 3426/4885
US-20060258627-A1 Resistance-repellent retroviral protease inhibitors SERPINB1, MMP7, MME LTB4R 2842/4885LTB4R2 3632/4885HCRTR2 3426/4885
US-11186564-B2 Dual NAV1.2/5HT2a inhibitors for treating CNS disorders SCN2A, HTR2A, HTR2C LTB4R 3955/4885LTB4R2 2763/4885HCRTR2 70/4885
US-10693080-B2 Solvent for producing organic transistor SCO2, SLCO2A1, OXSR1 LTB4R 256/4885LTB4R2 486/4885HCRTR2 1436/4885
US-20230303552-A1 ARYLSULFONYL DERIVATIVES AND THEIR USE AS MUSCARINIC ACETYLCHOLINE RECEPTOR M5 INHIBITORS CHRM5, CHRM1, CHRM2 LTB4R 1554/4885LTB4R2 2262/4885HCRTR2 377/4885

“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.