SCHEMBL302841

SCHEMBL302841

OCCCCC#CC#CCCCCO

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
SELP P16109 1/20 0.38
HMGCR P04035 2/20 0.38
PTPN7 P35236 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 2/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 1/20 0.33
PPARD Q03181 1/20 0.32

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
SCHEMBL10780122 0.97 ALDH1A1 (0.38) ALDH1A1KDM4ECYP1A2CYP3A4MAPT
SCHEMBL1168913 0.97 HMGCR (0.41) ALDH1A1KDM4ECYP1A2CYP3A4MAPT
SCHEMBL10781785 0.97 ALDH1A1 (0.38) ALDH1A1KDM4ECYP1A2CYP3A4MAPT
SCHEMBL1168708 0.97 HMGCR (0.41) ALDH1A1KDM4ECYP1A2CYP3A4MAPT
SCHEMBL1169234 0.97 HMGCR (0.41) ALDH1A1KDM4ECYP1A2CYP3A4MAPT
SCHEMBL1169581 0.97 HMGCR (0.41) ALDH1A1KDM4ECYP1A2CYP3A4MAPT
SCHEMBL1765934 0.97 HMGCR (0.41) ALDH1A1KDM4ECYP1A2CYP3A4MAPT
SCHEMBL302078 0.90 SELP (0.35) ALDH1A1KDM4ECYP1A2CYP3A4MAPT
Cyclohexane SCHEMBL11265981 0.89 KDM4E (0.34) ALDH1A1KDM4ECYP1A2CYP3A4MAPT
SCHEMBL11120991 0.87 SELP (0.34) ALDH1A1KDM4ECYP1A2CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108547010-B Preparation method of light/heat double-photochromic fiber, and obtained material and application thereof 江南大学 2020-09-22 CN claimed
US-9163307-B2 Three-dimensional photoresists via functionalization of polymer thin films fabricated by iCVD MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-10-20 US claimed
US-20130260054-A1 Three-Dimensional Photoresists via Functionalization of Polymer Thin Films Fabricated by iCVD MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-10-03 US claimed
US-20130068155-A1 FREEZE, THAW AND REFREEZE INDICATORS BASED ON RAPID REACTIONS IN THE SOLID STATE JP LABORATORIES INC. 2013-03-21 US claimed
US-8278631-B2 Time-temperature, UV exposure and temperature indicator JP LABORATORIES INC. 2012-10-02 US claimed
EP-1529089-B1 THICK RADIATION SENSITIVE DEVICES JP LAB INC (US) 2012-06-06 EP claimed
US-8115182-B1 Personal and area self-indicating radiation alert dosimeter JP LABORATORIES INC. 2012-02-14 US claimed
JP-4852410-B2 2012-01-11 JP claimed
US-20090224176-A1 A SELF INDICATING MULTI-SENSOR RADIATION DOSIMETER JP LABORATORIES, INC. 2009-09-10 US claimed
US-20090128345-A1 TIME-TEMPERATURE, UV EXPOSURE AND TEMPERATURE INDICATOR JP LABORATORIES INC. 2009-05-21 US claimed
US-20010046451-A1 Freeze monitoring device JP LABS, INC. 2001-11-29 US claimed
EP-0592575-B1 ORGANIC-INORGANIC POLYMERIC COMPOSITES DU PONT (US) 1998-03-18 EP claimed
US-5672465-A SELF DEVELOPING FILM COMPRISES ATLEAST ONE RADIATION SENITIVE DIACETYLENE MATERIAL, CONVERTER WHICH ASSOCIATES AS COMPLEX OR SOLID SOLUTION WITH BINDER IS CAPABLE UPON CONTACT WITH HIGH ENERGY RADIATION TO FORM AN IMAGE, AND A SUBSTRATE JP LABORATORIES, INC. (US) 1997-09-30 US claimed
WO-1996021885-A1 HEAT FIXABLE HIGH ENERGY RADIATION IMAGING FILM JP LABORATORIES, INC. (US) 1996-07-18 WO claimed
US-4783136-A Optical waveguides and methods for making same GTE LABORATORIES INCORPORATED (US) 1988-11-08 US claimed
EP-0241703-A2 Optical waveguides and methods for making same GTE LABORATORIES INCORPORATED (US) 1987-10-21 EP claimed
EP-0228272-A2 Preparation of urethane substituted diacetylene monomers and polymers GTE LABORATORIES INCORPORATED (US) 1987-07-08 EP claimed
US-4389217-A IRREVERSIBLE END-POINT COLOR AFTER POLYMERIZATION OF A CONJUGATED DIYNE MOMONER ALLIED CORPORATION (US) 1983-06-21 US claimed
US-4195056-A FOR MONITORING SHELF LIFE; COLOR RESPONSE ALLIED CHEMICAL CORPORATION (US) 1980-03-25 US claimed
US-4189399-A UNDERGOES COLOR CHANGE WHEN EXPOSED TO ACTINIC RADIATION OR ANNEALING ALLIED CHEMICAL CORPORATION (US) 1980-02-19 US claimed