SCHEMBL656696

SCHEMBL656696

C=Cc1ccc(/C=C/CCC)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TSHR P16473 2/20 0.37
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA7 P36544 1/20 0.37
CHRNA4 P43681 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
TNNC1 P63316 1/20 0.36
SIGMAR1 Q99720 2/20 0.34
KCNH2 Q12809 2/20 0.34
TDP1 Q9NUW8 1/20 0.33
TLR8 Q9NR97 1/20 0.33

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
SCHEMBL656698 1.00 ALDH1A1 (0.48) ALDH1A1TAS1R3TAS1R1TSHRCHRNB2
SCHEMBL657475 0.88 ALDH1A1 (0.44) ALDH1A1TAS1R3TAS1R1TSHRCHRNB2
SCHEMBL657473 0.88 ALDH1A1 (0.44) ALDH1A1TAS1R3TAS1R1TSHRCHRNB2
SCHEMBL1140653 0.84 TNNC1 (0.51) ALDH1A1TSHRTNNC1KCNH2
SCHEMBL1140656 0.84 TNNC1 (0.51) ALDH1A1TSHRTNNC1KCNH2
SCHEMBL659018 0.82 ALDH1A1 (0.52) ALDH1A1TAS1R3TAS1R1TSHRCHRNB2
SCHEMBL659019 0.82 ALDH1A1 (0.52) ALDH1A1TAS1R3TAS1R1TSHRCHRNB2
SCHEMBL6963714 0.80 NFE2L2 (0.46)
SCHEMBL2302497 0.80 NFE2L2 (0.46)
SCHEMBL1051328 0.80 NFE2L2 (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150322186-A1 METHODS AND MATERIALS FOR HYDROCARBON RECOVERY PENN STATE RES FOUND (US) 2015-11-12 US claimed
US-9109057-B2 Methods and materials for hydrocarbon recovery THE PENN STATE RESEARCH FOUNDATION (US) 2015-08-18 US claimed
WO-2012024614-A2 METHODS AND MATERIALS FOR HYDROCARBON RECOVERY THE PENN STATE RESEARCH FOUNDATION (US) 2012-02-23 WO claimed
US-20120046419-A1 METHODS AND MATERIALS FOR HYDROCARBON RECOVERY THE PENN STATE RESEARCH FOUNDATION 2012-02-23 US claimed
CN-108271378-B Polyolefin interpenetrating network material for hydrocarbon recovery 宾夕法尼亚州立大学研究基金会 2020-07-31 CN disclosed
EP-3350238-A1 POLYOLEFIN INTERPENETRATED NETWORK MATERIAL FOR HYDROCARBON RECOVERY The Penn State Research Foundation (US) 2018-07-25 EP disclosed
US-9861954-B2 Polyolefin interpenetrated network material for hydrocarbon recovery THE PENN STATE RESEARCH FOUNDATION (US) 2018-01-09 US disclosed
US-9688895-B2 Methods and materials for hydrocarbon recovery THE PENN STATE RESEARCH FOUNDATION (US) 2017-06-27 US disclosed
US-20170080404-A1 POLYOLEFIN INTERPENETRATED NETWORK MATERIAL FOR HYDROCARBON RECOVERY THE PENN STATE RESEARCH FOUNDATION 2017-03-23 US disclosed
WO-2017048477-A1 POLYOLEFIN INTERPENETRATED NETWORK MATERIAL FOR HYDROCARBON RECOVERY THE PENN STATE RESEARCH FOUNDATION (US) 2017-03-23 WO disclosed
US-20160355715-A1 METHODS AND MATERIALS FOR HYDROCARBON RECOVERY THE PENN STATE RESEARCH FOUNDATION 2016-12-08 US disclosed
US-20150322186-A1 METHODS AND MATERIALS FOR HYDROCARBON RECOVERY PENN STATE RES FOUND (US) 2015-11-12 US disclosed
US-9109057-B2 Methods and materials for hydrocarbon recovery THE PENN STATE RESEARCH FOUNDATION (US) 2015-08-18 US disclosed
WO-2012024614-A2 METHODS AND MATERIALS FOR HYDROCARBON RECOVERY THE PENN STATE RESEARCH FOUNDATION (US) 2012-02-23 WO disclosed
US-20120046419-A1 METHODS AND MATERIALS FOR HYDROCARBON RECOVERY THE PENN STATE RESEARCH FOUNDATION 2012-02-23 US disclosed
US-6433083-B2 MOLDING MATERIAL; HEAT AND SOLVENT RESISTANCE, TOUGHNESS, TENSILE STRENGTH, ELONGATION, TRANSPARENT IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2002-08-13 US disclosed
US-20010025085-A1 Aromatic vinyl resin material and molded products thereof IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-09-27 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 (2 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-20120046419-A1 METHODS AND MATERIALS FOR HYDROCARBON RECOVERY LIPA, HSPH1, HPGDS ALDH1A1 3406/4885TAS1R3 3244/4885TAS1R1 3785/4885
US-20170080404-A1 POLYOLEFIN INTERPENETRATED NETWORK MATERIAL FOR HYDROCARBON RECOVERY PUF60, PARN, PARG ALDH1A1 4465/4885TAS1R3 3807/4885TAS1R1 4159/4885

“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.