SCHEMBL5085357

SCHEMBL5085357

CC(C)(CCl)c1ccccc1.[MgH2]

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.56
MAPK1 P28482 1/20 0.42
TSHR P16473 2/20 0.42
CYP2C19 P33261 1/20 0.40
HIF1A Q16665 1/20 0.40
ALDH1A1 P00352 3/20 0.39
ALOX15 P16050 1/20 0.39
KCNN4 O15554 4/20 0.38
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL1502452 0.97 TAAR1 (0.58) TAAR1MAPK1TSHRCYP2C19HIF1A
SCHEMBL7165155 0.84 SHBG (0.42) TAAR1TSHRESR1ESR2CYP3A4
SCHEMBL11742223 0.78 TAAR1 (0.54) TAAR1MAPK1TSHRCYP2C19HIF1A
SCHEMBL28272853 0.77 TAAR1 (0.46) TAAR1MAPK1TSHRCYP2C19HIF1A
SCHEMBL10524759 0.77 TSHR (0.48) MAPK1TSHRALDH1A1MAPT
SCHEMBL3368788 0.76 TAAR1 (0.64) TAAR1MAPK1TSHRCYP2C19HIF1A
SCHEMBL10837089 0.75 MEN1 (0.52) MAPK1TSHRHIF1AKMT2A
SCHEMBL9211954 0.75 TSHR (0.52) TAAR1TSHRCYP2C19ALDH1A1ALOX15
SCHEMBL272389 0.75 TAAR1 (0.56) TAAR1MAPK1TSHRCYP2C19HIF1A
SCHEMBL6015470 0.75 TSHR (0.48) TAAR1MAPK1TSHRCYP2C19HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118251380-A Spiro- (indan-fluorene) compounds and their use in organic electronic devices 多蒂肯独家合成控股公司 2024-06-25 CN disclosed
US-10577460-B2 Method for producing polyester NIPPON SODA CO., LTD. (JP) 2020-03-03 US disclosed
US-20180022867-A1 METHOD FOR PRODUCING POLYESTER NIPPON SODA CO., LTD. (JP) 2018-01-25 US disclosed
EP-3248998-A1 METHOD FOR PRODUCING POLYESTER Nippon Soda Co., Ltd. (JP) 2017-11-29 EP disclosed
EP-1487886-B1 SUBSTITUTED INDENYL METAL COMPLEXES AND POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC (US) 2008-08-06 EP disclosed
US-7262183-B2 Substituted 5-membered n-heterocyclic compounds and their uses for treating or preventing neurodegenerative diseases Instititute of Pharmacology and Toxicology (CN) 2007-08-28 US disclosed
US-7098356-B2 Substituted indenyl metal complexes and polymerization process DOW GLOBAL TECHNOLOGIES INC. (US) 2006-08-29 US disclosed
US-20050171166-A1 Substituted 5-membered n-heterocyclic compounds and their uses for treating or preventing neurodegenerative diseases INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICNI SCIENCES P.L.A. CHINA (CN) 2005-08-04 US disclosed
US-20050143536-A1 Substituted indenyl metal complexes and polymerization process DOW GLOBAL TECHNOLOGIES LLC 2005-06-30 US disclosed
EP-1487886-A1 SUBSTITUTED INDENYL METAL COMPLEXES AND POLYMERIZATION PROCESS Dow Global Technologies Inc. (US) 2004-12-22 EP disclosed
WO-2003078483-A1 SUBSTITUTED INDENYL METAL COMPLEXES AND POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC. (US) 2003-09-25 WO disclosed
US-6518375-B1 Trivalent alkyl chromium compound catalyst for the production of an ethylene polymer JAPAN POLYOLEFINS CO., LTD. (JP) 2003-02-11 US disclosed
EP-1041085-B1 Catalyst for the production of ethylene polymer and process for producing ethylene polymer JAPAN POLYOLEFINS CO LTD (JP) 2002-08-14 EP disclosed
EP-1041085-A1 Catalyst for the production of ethylene polymer and process for producing ethylene polymer Japan Polyolefins Co., Ltd. (JP) 2000-10-04 EP 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-20050143536-A1 Substituted indenyl metal complexes and polymerization process ORC3, SOD1, YAP1 TAAR1 4168/4885MAPK1 2615/4885TSHR 4707/4885
US-20050171166-A1 Substituted 5-membered n-heterocyclic compounds and their uses for treating or preventing neurodegenerative diseases BDNF, NGF, NTRK2 TAAR1 4533/4885MAPK1 3066/4885TSHR 3344/4885

“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.