SCHEMBL1147722

SCHEMBL1147722

Cc1c(F)c(=O)oc2cc(O)c(F)c(F)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B3 P37058 2/20 0.51
▸ ESR1 P03372 3/20 0.40
▸ ESR2 Q92731 3/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ NUAK1 O60285 2/20 0.40
▸ IGF1R P08069 2/20 0.40
▸ PIM1 P11309 2/20 0.40
▸ SRC P12931 2/20 0.40
▸ KDR P35968 2/20 0.40
▸ PLK1 P53350 2/20 0.40
▸ PKN1 Q16512 2/20 0.40
▸ AURKB Q96GD4 2/20 0.40
▸ ALK Q9UM73 2/20 0.40
▸ MET P08581 1/20 0.40
▸ AXL P30530 1/20 0.40
▸ NEK2 P51955 1/20 0.40
▸ PTK2 Q05397 1/20 0.40
▸ NEK6 Q9HC98 1/20 0.40
▸ CLK2 P49760 1/20 0.40

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
SCHEMBL1095047 0.86 HSD17B3 (0.44) HSD17B3ESR1ESR2PTGS1PTGS2
SCHEMBL21379597 0.82 HSD17B3 (0.46) HSD17B3ESR1ESR2CLK2KDM4E
SCHEMBL3063473 0.79 HSD17B3 (0.44) HSD17B3ESR1ESR2SRCCLK2
SCHEMBL20957619 0.78 HSD17B3 (0.58) HSD17B3ESR1ESR2NUAK1IGF1R
SCHEMBL2454830 0.78 ALDH1A1 (0.50) HSD17B3PTGS1PTGS2KDM4EALDH1A1
SCHEMBL25190307 0.77 HSD17B3 (0.42) HSD17B3ESR1ESR2KDM4EALDH1A1
SCHEMBL10790857 0.76 HSD17B3 (0.51) HSD17B3ESR1ESR2KDM4EALDH1A1
SCHEMBL4058366 0.76 RXFP1 (0.47) HSD17B3KDM4EALDH1A1CASP1CASP7
SCHEMBL8570027 0.74 CA12 (0.43) ALDH1A1GAASMN1; SMN2LMNAMAOA
SCHEMBL27907872 0.72 ALDH2 (0.47) HSD17B3ESR1ESR2PTGS1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106249503-A Optical element and electrophoretic display for display device 广州奥翼电子科技股份有限公司 2016-12-21 — — CN claimed
EP-2287607-B1 METHOD FOR QUANTIFICATION OF ANTIGEN-SPECIFIC CANINE OR HUMAN IGE RIKEN (JP) 2018-08-22 — — EP disclosed
US-8716031-B2 Method for quantification of antigen-specific canine IgE RIKEN (JP) 2014-05-06 — — US disclosed
US-20110275646-A1 Novel Compounds for Treatment of Cancer and Disorders Associated with Angiogenesis Function UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2011-11-10 — — US disclosed
US-7947682-B2 Substituted N′-pyrrolo[1,2-a]quinoxalin-4-yl-hydrazides as anti-cancer agents UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2011-05-24 — — US disclosed
US-20110111529-A1 METHOD FOR QUANTIFICATION OF ANTIGEN-SPECIFIC CANINE OR HUMAN IGE RIKEN (JP) 2011-05-12 — — US disclosed
EP-2287607-A1 METHOD FOR QUANTIFICATION OF ANTIGEN-SPECIFIC CANINE OR HUMAN IGE Riken (JP) 2011-02-23 — — EP disclosed
US-20110034472-A1 Novel Compounds for Treatment of Cancer and Disorders Associated With Angiogenesis Function UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2011-02-10 — — US disclosed
US-20100120781-A1 Novel Compounds for Treatment of Cancer and Disorders Associated with Angiogenesis Function UNIVERSITY OF SOUTHERN CALIFORNIA 2010-05-13 — — US disclosed
US-20090093489-A1 NOVEL COMPOUNDS FOR TREATMENT OF CANCER AND DISORDERS ASSOCIATED WITH ANGIOGENESIS FUNCTION UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2009-04-09 — — US disclosed
EP-1816913-A1 NOVEL COMPOUNDS FOR TREATMENT OF CANCER AND DISORDERS ASSOCIATED WITH ANGIOGENESIS FUNCTION UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2007-08-15 — — EP disclosed
US-20060235034-A1 Novel compounds for treatment of cancer and disorders associated with angiogenesis function UNIVERSITY OF SOUTHERN CALIFORNIA 2006-10-19 — — US disclosed
WO-2006091246-A1 NOVEL COMPOUNDS FOR TREATMENT OF CANCER AND DISORDERS ASSOCIATED WITH ANGIOGENESIS FUNCTION UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2006-08-31 — — WO disclosed
US-20060142294-A1 Novel compounds for treatment of cancer and disorders associated with angiogenesis function UNIVERSITY OF SOUTHERN CALIFORNIA 2006-06-29 — — 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 (6 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-20060142294-A1 Novel compounds for treatment of cancer and disorders associated with angiogenesis function VEGFA, TEK, LIPG HSD17B3 3319/4885ESR1 2936/4885ESR2 1009/4885
US-20110275646-A1 Novel Compounds for Treatment of Cancer and Disorders Associated with Angiogenesis Function VEGFA, TEK, LIPG HSD17B3 3319/4885ESR1 2936/4885ESR2 1009/4885
US-20110034472-A1 Novel Compounds for Treatment of Cancer and Disorders Associated With Angiogenesis Function VEGFA, TEK, MCL1 HSD17B3 3370/4885ESR1 3152/4885ESR2 1232/4885
US-20090093489-A1 NOVEL COMPOUNDS FOR TREATMENT OF CANCER AND DISORDERS ASSOCIATED WITH ANGIOGENESIS FUNCTION VEGFA, TEK, MCL1 HSD17B3 3370/4885ESR1 3152/4885ESR2 1232/4885
US-20100120781-A1 Novel Compounds for Treatment of Cancer and Disorders Associated with Angiogenesis Function VEGFA, TEK, MCL1 HSD17B3 3370/4885ESR1 3152/4885ESR2 1232/4885
US-20060235034-A1 Novel compounds for treatment of cancer and disorders associated with angiogenesis function VEGFA, TEK, MCL1 HSD17B3 3370/4885ESR1 3152/4885ESR2 1232/4885

“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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