SCHEMBL1140656

SCHEMBL1140656

C=Cc1ccc(C=CCCCCCC)cc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.51
TSHR P16473 1/20 0.43
KCNH2 Q12809 1/20 0.42
ALDH1A1 P00352 1/20 0.41
MEN1 O00255 1/20 0.40
CYP3A4 P08684 1/20 0.40
KMT2A Q03164 1/20 0.40
FAAH O00519 2/20 0.39
TRPV1 Q8NER1 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
PTGS1 P23219 1/20 0.38
PPARG P37231 1/20 0.38
OPRK1 P41145 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
MGLL Q99685 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
SCHEMBL1140653 1.00 TNNC1 (0.51) TNNC1TSHRKCNH2ALDH1A1MEN1
SCHEMBL657473 0.92 ALDH1A1 (0.44) TNNC1TSHRKCNH2ALDH1A1CA1
SCHEMBL657475 0.92 ALDH1A1 (0.44) TNNC1TSHRKCNH2ALDH1A1CA1
SCHEMBL6046924 0.88 TNNC1 (0.55) TNNC1TSHRKCNH2ALDH1A1FAAH
SCHEMBL6633876 0.85 TNNC1 (0.53) TNNC1KCNH2ALDH1A1MEN1CYP3A4
SCHEMBL656696 0.84 ALDH1A1 (0.48) TNNC1TSHRKCNH2ALDH1A1
SCHEMBL656698 0.84 ALDH1A1 (0.48) TNNC1TSHRKCNH2ALDH1A1
Heptane SCHEMBL11256407 0.84 ALDH1A1 (0.58) TSHRALDH1A1MEN1KMT2ACA1
Styrene SCHEMBL2380965 0.84 ALDH1A1 (0.50) TNNC1TSHRALDH1A1
Styrene SCHEMBL2261497 0.82 ALDH1A1 (0.48) TNNC1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111051487-A Cleaning liquid composition and method for cleaning polymerization apparatus using the same 株式会社LG化学 2020-04-21 CN disclosed
US-20150093508-A1 COMPOSITION FOR PATTERN FORMATION AND PATTERN-FORMING METHOD JSR CORPORATION (JP) 2015-04-02 US disclosed
US-7888401-B2 Ink composition and inkjet ink, and image-forming method and recorded material using the same, and oxetane compound FUJIFILM CORPORATION (JP) 2011-02-15 US disclosed
US-7703907-B2 Ink composition, inkjet-recording method and printed material FUJIFILM CORPORATION (JP) 2010-04-27 US disclosed
US-20080033072-A1 Ink composition and inkjet ink, and image-forming method and recorded material using the same, and oxetane compound FUJIFILM CORPORATION (JP) 2008-02-07 US disclosed
US-20060222832-A1 Ink composition, inkjet-recording method and printed material FUJI PHOTO FILM CO., LTD. 2006-10-05 US disclosed
CN-1178820-A Polypropene pressure sensitive adhesive tape and making method WANG JIANGUO (CN) 1998-04-15 CN disclosed
US-4239806-A ADHESIVE COMPRISING A BLOCK COPOLYMER OF STYRENE, A CONJUGATED DIENE, AND A HYDROCARBYL SUBSTITUTED STYRENE PHILLIPS PETROLEUM COMPANY (US) 1980-12-16 US disclosed
US-4178275-A Block copolymers of dienes and hydrocarbyl-substituted styrenes as adhesives PHILLIPS PETROLEUM COMPANY (US) 1979-12-11 US disclosed
US-4136137-A PRESSURE SENSITIVE ADHESIVES PHILLIPS PETROLEUM COMPANY (US) 1979-01-23 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 (1 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-20080033072-A1 Ink composition and inkjet ink, and image-forming method and recorded material using the same, and oxetane compound OXER1, IPO11, NOXO1 TNNC1 3125/4885TSHR 4803/4885KCNH2 2613/4885

“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.