SCHEMBL111168

SCHEMBL111168

CCCOc1ccc(N)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.67
TSHR P16473 1/20 0.67
RAB9A P51151 6/20 0.57
MAPT P10636 3/20 0.57
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
CA12 O43570 1/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
CA7 P43166 1/20 0.57
CA9 Q16790 1/20 0.57
LTA4H P09960 1/20 0.55
NPC1 O15118 5/20 0.53
HTT P42858 2/20 0.53
HSD17B10 Q99714 2/20 0.53
LMNA P02545 1/20 0.53
KDM4E B2RXH2 3/20 0.52
ALDH1A1 P00352 2/20 0.52
TP53 P04637 2/20 0.52
GAA P10253 2/20 0.52

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
SCHEMBL27888211 0.94 LTA4H (0.66) TDP1TSHRRAB9AMAPTMEN1
SCHEMBL5380417 0.94 RAB9A (0.60) TDP1TSHRRAB9AMAPTMEN1
SCHEMBL112238 0.91 TSHR (0.67) TDP1TSHRRAB9AMAPTKMT2A
Diethylamine SCHEMBL1284722 0.90 TDP1 (0.55) TDP1TSHRRAB9AMAPTMEN1
SCHEMBL7934865 0.90 LTA4H (0.56) TDP1TSHRRAB9AMAPTMEN1
SCHEMBL25877289 0.88 MEN1 (0.54) TDP1TSHRRAB9AMAPTMEN1
Formic Acid SCHEMBL27886420 0.88 TDP1 (0.53) TDP1TSHRRAB9AMAPTMEN1
1,4-Dipropoxybenzene SCHEMBL122039 0.87 LTA4H (0.67) RAB9AMAPTMEN1KMT2ACA12
SCHEMBL12012139 0.87 APP (0.57) TDP1TSHRRAB9AMAPTMEN1
SCHEMBL11522755 0.87 APP (0.57) TDP1TSHRRAB9AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118085890-A Liquid crystal aligning agent and preparation method and application thereof 合肥中聚和成电子材料有限公司 2024-05-28 CN claimed
CN-117866199-B Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display element thereof 烟台三月科技有限责任公司 2024-05-28 CN claimed
CN-117916657-A Liquid crystal aligning agent, liquid crystal alignment film, method for manufacturing liquid crystal display element, and liquid crystal display element 日产化学株式会社 2024-04-19 CN claimed
CN-117866199-A Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display element thereof 烟台三月科技有限责任公司 2024-04-12 CN claimed
CN-117753235-A Preparation method and application of block polyimide asymmetric membrane 天津理工大学 2024-03-26 CN claimed
CN-114761487-B Polymer composition, liquid crystal aligning agent, liquid crystal alignment film, liquid crystal display element, and method for manufacturing liquid crystal display element 日产化学株式会社 2024-02-20 CN claimed
CN-112888726-B Novel amic acid oligomer process for molding polyimide composites 钟化美洲控股公司 2023-10-03 CN claimed
CN-116814278-A Liquid crystal aligning agent, liquid crystal alignment film prepared by using the same and display element containing the alignment film 合肥中聚和成电子材料有限公司 2023-09-29 CN claimed
CN-116655673-A Boron-nitrogen coordination bond-containing spiro compound and organic electroluminescent device 江汉大学 2023-08-29 CN claimed
CN-116655672-A Boron-nitrogen compound and organic electroluminescent device 江汉大学 2023-08-29 CN claimed
US-20040110778-A1 Heterocyclic compounds as ligands of the GABAA receptor YOHANNES DANIEL (US) 2004-06-10 US claimed
EP-1325006-A2 HETEROCYCLIC COMPOUNDS AS LIGANDS OF THE GABA A? RECEPTOR NEUROGEN CORPORATION (US) 2003-07-09 EP claimed
US-20030105081-A1 Heterocyclic compounds as ligands of the GABAA receptor PFIZER INC 2003-06-05 US claimed
EP-0873989-B1 Process for the preparation of distyryl-biphenyl compounds CIBA SC HOLDING AG (CH) 2002-03-20 EP claimed
WO-2002012442-A2 HETEROCYCLIC COMPOUNDS AS LIGANDS OF THE GABAA RECEPTOR NEUROGEN CORPORATION (US) 2002-02-14 WO claimed
US-5952524-A Process CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-09-14 US claimed
CN-1198435-A Method for producing fluorescent whitening agent CIBA GEIGY AG (CH) 1998-11-11 CN claimed
EP-0873988-A2 Process for the preparation of distyryl-biphenyl compounds Ciba SC Holding AG (CH) 1998-10-28 EP claimed
EP-0873989-A2 Process for the preparation of distyryl-biphenyl compounds Ciba SC Holding AG (CH) 1998-10-28 EP claimed
US-3953510-A Method for the preparation of alkoxyanilines OLIN CORPORATION (US) 1976-04-27 US claimed

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-20030105081-A1 Heterocyclic compounds as ligands of the GABAA receptor GABRB1, GABRP, GABRA1 TDP1 2846/4885TSHR 252/4885RAB9A 962/4885
US-20040110778-A1 Heterocyclic compounds as ligands of the GABAA receptor GABRB1, GABRP, GABRA1 TDP1 2846/4885TSHR 252/4885RAB9A 962/4885

“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.