SCHEMBL7150972

SCHEMBL7150972

CC(=Cc1ccccc1)C(F)=Cc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.59
ALDH1A1 P00352 2/20 0.48
TSHR P16473 1/20 0.48
HTT P42858 1/20 0.44
FBP1 P09467 2/20 0.44
RAB9A P51151 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
NPC1 O15118 2/20 0.42
DHODH Q02127 1/20 0.42
TRPM8 Q7Z2W7 1/20 0.42
KDM1A O60341 1/20 0.41
RECQL P46063 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PKM P14618 1/20 0.40
MAPK1 P28482 1/20 0.40
F2 P00734 1/20 0.39
GAA P10253 1/20 0.39
STAT1 P42224 1/20 0.39
GLA P06280 1/20 0.39

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
SCHEMBL6433811 0.83 AKR1C3 (0.73) AKR1C3ALDH1A1TSHRHTTFBP1
SCHEMBL19712514 0.83 ALDH1A1 (0.46) AKR1C3ALDH1A1TSHRFBP1
SCHEMBL19712515 0.83 ALDH1A1 (0.46) AKR1C3ALDH1A1TSHRFBP1
SCHEMBL23458002 0.83 AKR1C3 (0.73) AKR1C3ALDH1A1TSHRHTTFBP1
SCHEMBL17813267 0.80 AKR1C3 (0.57) AKR1C3ALDH1A1TSHRHTTFBP1
SCHEMBL560553 0.80 AKR1C3 (0.69) AKR1C3ALDH1A1TSHRHTTFBP1
SCHEMBL5342048 0.78 AKR1C3 (0.67) AKR1C3ALDH1A1TSHRHTTFBP1
SCHEMBL5342051 0.78 AKR1C3 (0.67) AKR1C3ALDH1A1TSHRHTTFBP1
SCHEMBL14518618 0.78 ALDH1A1 (0.54) AKR1C3ALDH1A1TSHRHTTFBP1
SCHEMBL6804932 0.78 ALDH1A1 (0.54) AKR1C3ALDH1A1TSHRHTTFBP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8974594-B2 Microcapsule corrosion control in reinforced concrete EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2015-03-10 US disclosed
US-20120252934-A1 Microcapsule Corrosion Control In Reinforced Concrete EMPIRE TECHNOLOGY DEVELOPMENT, LLC (US) 2012-10-04 US disclosed
WO-2012134441-A1 MICROCAPSULE CORROSION CONTROL IN REINFORCED CONCRETE EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2012-10-04 WO disclosed
US-20030022105-A1 TWO -PHOTON UPCONVERTING DYES AND APPLICATIONS PRASAD PARAS N (US) 2003-01-30 US disclosed
US-6402037-B1 Two-photon upconverting dyes and applications THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2002-06-11 US disclosed
WO-2001037266-A9 THREE DIMENSIONAL DATA STORAGE DEVICE AND METHOD FOR READING UNIV NEW YORK STATE RES FOUND (US) 2002-05-23 WO disclosed
WO-2001037266-A1 THREE DIMENSIONAL DATA STORAGE DEVICE AND METHOD FOR READING THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2001-05-25 WO disclosed
US-5912257-A COMPRISING A MATRIX AND STYRYL DYES AND CPOPOSITIONS SHOWING SUPERIOR TWO PHOTON ABSORPTION CROSS-SECTIONS; LASER COMPRISING SOUCE CAPABLE OF PRODUCING INFRARED RADIATION; MULTIPHASE MULTISTRUCTURAL COMPOSITES THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1999-06-15 US disclosed
EP-0862432-A1 TWO-PHOTON UPCONVERTING DYES AND APPLICATIONS THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1998-09-09 EP disclosed
WO-1997009043-A9 TWO-PHOTON UPCONVERTING DYES AND APPLICATIONS 1997-09-18 WO disclosed
US-4109072-A FOR WATER SLUDGE TREATMENT, PAPER TREATMENT, FIBER MANUFACTURE AMERICAN CYANAMID COMPANY (US) 1978-08-22 US disclosed
US-4088631-A N-(1-METHYL-3-ARYL-3-OXOPROPYL) ALKYLAMIDES AS ANTIOXIDANTS AND THERMO- AND UV STABILIZERS THE GOODYEAR TIRE AND RUBBER COMPANY (US) 1978-05-09 US disclosed
US-4074055-A Process for preparing unsaturated imidazolines AMERICAN CYANAMID COMPANY (US) 1978-02-14 US disclosed
US-4048227-A LIGHT STABILIZER, COPOLYMERIZING MONOMER THE GOODYEAR TIRE & RUBBER COMPANY (US) 1977-09-13 US disclosed
US-4039542-A WATER TREATMENT AMERICAN CYANAMID COMPANY (US) 1977-08-02 US disclosed
US-4007089-A Method for binding biologically active compounds NELSON RESEARCH & DEVELOPMENT COMPANY (US) 1977-02-08 US disclosed
US-4004621-A Liquid-dispensing nozzle assembly ATLANTIC RICHFIELD COMPANY (US) 1977-01-25 US disclosed
US-4003416-A Liquid-dispensing nozzle assembly ATLANTIC RICHFIELD COMPANY (US) 1977-01-18 US disclosed
US-3995669-A Liquid-dispensing nozzle assembly ATLANTIC RICHFIELD COMPANY (US) 1976-12-07 US disclosed
US-3943114-A Polymers of N-aminoalkyl acrylamides THE LUBRIZOL CORPORATION (US) 1976-03-09 US disclosed