SCHEMBL5231365

SCHEMBL5231365

Cc1ccc(C=C(O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(O)=Cc2ccc(C)c(F)c2)cc1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR183 P32249 1/20 0.34
▸ TUBB1 Q9H4B7 2/20 0.34
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ GABRA1 P14867 1/20 0.33
▸ SIGMAR1 Q99720 1/20 0.33
▸ AKR1C3 P42330 1/20 0.33
▸ AKR1C2 P52895 1/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ KMT2A Q03164 1/20 0.32
▸ TRPA1 O75762 1/20 0.32
▸ ALOX5 P09917 1/20 0.31
▸ PTGS1 P23219 1/20 0.31
▸ PTGS2 P35354 1/20 0.31
▸ KMO O15229 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ NPC1 O15118 1/20 0.30

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
SCHEMBL27509707 0.90 PDE4A (0.33) GPR183GABRA1SIGMAR1KMT2ATRPA1
SCHEMBL5231765 0.87 GABRA1 (0.46) TUBB1GABRA1SIGMAR1NFE2L2TRPA1
SCHEMBL27176003 0.87 GABRA1 (0.46) TUBB1GABRA1SIGMAR1NFE2L2TRPA1
SCHEMBL20599343 0.84 TUBB1 (0.37) TUBB1KMT2AALOX5PTGS1PTGS2
SCHEMBL34956 0.84 TUBB1 (0.37) TUBB1KMT2AALOX5PTGS1PTGS2
SCHEMBL29373037 0.84 TUBB1 (0.37) TUBB1KMT2AALOX5PTGS1PTGS2
SCHEMBL5229472 0.84 TRPA1 (0.41) NFE2L2KMT2ATRPA1PTGS2MAPT
SCHEMBL5229721 0.83 GABRA1 (0.46) TUBB1GABRA1SIGMAR1NFE2L2TRPA1
SCHEMBL28684322 0.83 GABRA1 (0.46) TUBB1GABRA1SIGMAR1NFE2L2TRPA1
SCHEMBL6015160 0.81 HPGD (0.34) KMT2ATRPA1TSHRNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313741-B1 FLUORINATED AND ALKYLATED ALDITOL DERIVATIVES AND POLYOLEFIN ARTICLES CONTAINING SAME MILLIKEN & CO (US) 2007-05-23 — — EP claimed
EP-1409579-B1 CLARIFYING AGENT FORMULATIONS FOR THERMOPLASTICS EXHIBITING VERY HIGH NUCLEATION EFFICACY MILLIKEN & CO (US) 2006-12-20 — — EP claimed
US-6906207-B2 Polymer additive compositions and articles comprising novel fluorinated and alkylated alditol derivatives MILLIKEN & COMPANY (US) 2005-06-14 — — US claimed
EP-1409579-A4 CLARIFYING AGENT FORMULATIONS FOR THERMOPLASTICS EXHIBITING VERY HIGH NUCLEATION EFFICACY MILLIKEN & CO (US) 2005-03-09 — — EP claimed
US-6849747-B2 Fluorinated and alkylated dibenzylidene alditol derivatives MILLIKEN & COMPANY (US) 2005-02-01 — — US claimed
US-20040110967-A1 Novel fluorinated and alkylated dibenzylidene alditol derivatives ANDERSON JOHN D (US) 2004-06-10 — — US claimed
US-6734238-B2 RADIATION TRANSPARENT; ANTIPERSPIRANT GEL MILLIKEN & COMPANY 2004-05-11 — — US claimed
EP-1409579-A1 CLARIFYING AGENT FORMULATIONS FOR THERMOPLASTICS EXHIBITING VERY HIGH NUCLEATION EFFICACY Milliken & Company (US) 2004-04-21 — — EP claimed
US-20030181552-A1 Polymer additive compositions and articles comprising novel fluorinated and alkylated alditol derivatives ANDERSON JOHN D (US) 2003-09-25 — — US claimed
US-20030171462-A1 Polyolefin compositions and articles comprising novel fluorinated and alkylated alditol derivatives ANDERSON JOHN D (US) 2003-09-11 — — US claimed
US-6585819-B2 Polypropylene containing saturated bicyclic carboxylic acid and dibenzylidene alditol acetal derivative additives MILLIKEN & COMPANY 2003-07-01 — — US claimed
EP-1313741-A2 FLUORINATED AND ALKYLATED ALDITOL DERIVATIVES AND POLYOLEFIN ARTICLES CONTAINING SAME Milliken & Company (US) 2003-05-28 — — EP claimed
US-20030073764-A1 Clarified thermoplastics exhibiting very high nucleation efficacy MILLIKEN & COMPANY 2003-04-17 — — US claimed
WO-2003016421-A1 CLARIFIED THERMOPLASTICS EXHIBITING VERY HIGH NUCLEATION EFFICACY MILLIKEN & COMPANY (US) 2003-02-27 — — WO claimed
US-6521685-B1 Clarifying agent formulations for thermoplastics exhibiting very high nucleation efficacy MILLIKEN & COMPANY 2003-02-18 — — US claimed
WO-2003004554-A1 CLARIFYING AGENT FORMULATIONS FOR THERMOPLASTICS EXHIBITING VERY HIGH NUCLEATION EFFICACY MILLIKEN & COMPANY (US) 2003-01-16 — — WO claimed
US-20020062034-A1 Novel fluorinated and alkylated alditol derivatives and compositions and polyolefin articles containing same MILLIKEN &COMPANY 2002-05-23 — — US claimed
WO-2002020528-A2 FLUORINATED AND ALKYLATED ALDITOL DERIVATIVES AND POLYOLEFIN ARTICLES CONTAINING SAME MILLIKEN & COMPANY (US) 2002-03-14 — — WO claimed
CN-114058142-B Transparent fluorine-containing polymer film 浙江省化工研究院有限公司 2023-05-12 — — CN disclosed
WO-2002020528-A2 FLUORINATED AND ALKYLATED ALDITOL DERIVATIVES AND POLYOLEFIN ARTICLES CONTAINING SAME MILLIKEN & COMPANY (US) 2002-03-14 — — WO 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-20040110967-A1 Novel fluorinated and alkylated dibenzylidene alditol derivatives ALDOA, DERA, SORD GPR183 3753/4885TUBB1 969/4885HDAC1 2019/4885
US-20020062034-A1 Novel fluorinated and alkylated alditol derivatives and compositions and polyolefin articles containing same ALDOA, SORD, DERA GPR183 4022/4885TUBB1 927/4885HDAC1 1850/4885

“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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