SCHEMBL1856534

SCHEMBL1856534

CC(C)(C)C(c1ccccc1O)C(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.56
GABRB2 P47870 2/20 0.56
TSHR P16473 5/20 0.50
ALDH1A1 P00352 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
CA2 P00918 3/20 0.41
LMNA P02545 3/20 0.41
POLB P06746 2/20 0.41
CYP3A4 P08684 2/20 0.41
HPGD P15428 2/20 0.41
BLM P54132 2/20 0.41
HIF1A Q16665 2/20 0.41
ALOX15 P16050 2/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
CA12 O43570 1/20 0.41
GMNN O75496 1/20 0.41
EGFR P00533 1/20 0.41
FYN P06241 1/20 0.41

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
SCHEMBL11611880 0.83 TSHR (0.53) GABRA1GABRB2TSHRALDH1A1TDP1
SCHEMBL29048109 0.79 GABRA1 (0.54) GABRA1GABRB2TSHRALDH1A1TDP1
SCHEMBL980285 0.79 GABRA1 (0.48) GABRA1GABRB2TSHRALDH1A1TDP1
SCHEMBL6687058 0.76 GABRA1 (0.50) GABRA1GABRB2TSHRALDH1A1TDP1
SCHEMBL11011848 0.74 GABRA1 (0.48) GABRA1GABRB2TSHRALDH1A1TDP1
SCHEMBL671174 0.73 GABRA1 (0.65) GABRA1GABRB2TSHRALDH1A1TDP1
SCHEMBL12040025 0.73 ESR1 (0.50) GABRA1GABRB2TSHRALDH1A1TDP1
SCHEMBL2048574 0.73 GABRA1 (0.65) GABRA1GABRB2TSHRALDH1A1TDP1
SCHEMBL3415686 0.73 GABRA1 (0.65) GABRA1GABRB2TSHRALDH1A1TDP1
SCHEMBL5596304 0.73 GABRA1 (0.52) GABRA1GABRB2TSHRALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111423696-B Antibacterial and antiviral toilet cover and preparation method thereof 同曦集团有限公司 2023-08-18 CN claimed
CN-111808396-A Antibacterial plastic and preparation method thereof 浙江王氏科技有限公司 2020-10-23 CN claimed
CN-111423696-A Antibacterial and antiviral toilet lid and preparation method thereof 同曦集团有限公司 2020-07-17 CN claimed
CN-111253705-A Photocatalyst antibacterial, mildewproof and antiviral plastic product and preparation method thereof 同曦集团有限公司 2020-06-09 CN claimed
CN-110028669-A Negative photosensitive poly amic acid ester resin, resin combination, preparation method and application 明士新材料有限公司 2019-07-19 CN claimed
CN-106749780-B Preparation method of rare earth polymer 中国石油天然气股份有限公司 2019-07-05 CN claimed
CN-107987778-B A kind of household electrical appliances reaction type polyurethane hot-melt adhesive and preparation method thereof 杭州之江有机硅化工有限公司 2019-04-12 CN claimed
CN-109576010-A A kind of compound cleaning diesel oil and preparation method thereof 苑瀚文 2019-04-05 CN claimed
CN-107987778-A A kind of household electrical appliances reaction type polyurethane hot-melt adhesive and preparation method thereof 杭州之江有机硅化工有限公司 2018-05-04 CN claimed
CN-106543567-A A kind of automobile wiring harness sheath 黄山全晟密封科技有限公司 2017-03-29 CN claimed
CN-101016259-A Preparing method of high content full cis-beta-carotene preparation UNIV ZHEJIANG (CN) 2007-08-15 CN claimed
CN-1844071-A Phenol ortho alkylation method with high-conversion and high-selectivity BEIJING JIYI CHEMICALS CO LTD (CN) 2006-10-11 CN claimed
US-20060218855-A1 Method of increasing the oxidation stability of biodiesel DEGUSSA AG (DE) 2006-10-05 US claimed
WO-2006099946-A1 TRANSDERMAL THERAPEUTIC SYSTEM NEUROBIOTEC GMBH (DE) 2006-09-28 WO claimed
US-20060105030-A1 Transdermal therapeutic system AXXONIS PHARMA AG (DE) 2006-05-18 US claimed
CN-1742072-A Method for improving storage stability of biodiesel by using 2, 4-di-tert-butyl hydroxy toluene LANXESS DEUTSCHLAND GMBH (DE) 2006-03-01 CN claimed
US-20050220855-A1 Transdermal therapeutic system AXXONIS PHARMA AG (DE) 2005-10-06 US claimed
US-5629389-A Polymer-based electroluminescent device with improved stability HEWLETT-PACKARD COMPANY (US) 1997-05-13 US claimed
CN-1135704-A Preparation method of polyethylene material with positive temperature coefficient of resistivity CHANGCHUN APPLIED CHEMISTRY (CN) 1996-11-13 CN claimed
US-4698113-A Method of curing photocurable and heat-curable compositions and a method of adhering members to each other by using them MATSUSHITA ELECTRIC (JP) 1987-10-06 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-20050220855-A1 Transdermal therapeutic system TTPA, TXNRD1, TRHDE GABRA1 3831/4885GABRB2 3008/4885TSHR 505/4885
US-20060105030-A1 Transdermal therapeutic system TXNRD2, TTPA, TXNRD1 GABRA1 3854/4885GABRB2 2761/4885TSHR 475/4885

“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.