SCHEMBL372982

SCHEMBL372982

C=Cc1ccccc1CCN(CC)CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
HTR1A P08908 6/20 0.45
HTR6 P50406 3/20 0.45
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
NFKB1 P19838 1/20 0.39
CYP2C19 P33261 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPT P10636 1/20 0.39
HTR2A P28223 3/20 0.39
HRH3 Q9Y5N1 1/20 0.39
LMNA P02545 1/20 0.38
BLM P54132 1/20 0.38
DRD3 P35462 3/20 0.38
DRD1 P21728 2/20 0.38
ADRA2A P08913 2/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
ADRA1A P35348 2/20 0.38
SLC6A3 Q01959 2/20 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
SCHEMBL27912295 0.89 HTR1A (0.39) TSHRHTR1AHTR6CYP1A2CYP2D6
SCHEMBL11042852 0.84 TSHR (0.41) TSHRHTR1AHTR6CYP1A2CYP2D6
SCHEMBL997695 0.83 TSHR (0.46) TSHRCYP1A2CYP2D6NFKB1CYP2C19
SCHEMBL2023064 0.81 TAAR1 (0.53) HTR1AHTR6HTR2AHRH3ADRA2A
SCHEMBL14732598 0.81 TSHR (0.49) TSHRHTR1ACYP1A2CYP2D6NFKB1
SCHEMBL78218 0.79 ALDH1A1 (0.41) TSHRHTR1ACYP2D6ADRA2AADRA2B
SCHEMBL1487355 0.79 TSHR (0.42) TSHRHTR1ACYP1A2CYP2D6NFKB1
SCHEMBL595200 0.78 ALDH1A1 (0.48) TSHRCYP1A2MAPTLMNABLM
SCHEMBL29377653 0.78 ALDH1A1 (0.48) TSHRCYP1A2MAPTLMNABLM
SCHEMBL6292788 0.77 ALDH1A1 (0.34) HTR1AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3357943-B1 MODIFIED CONJUGATED DIENE-BASED POLYMER AND METHOD OF PREPARING THE SAME LG CHEMICAL LTD (KR) 2022-07-20 EP claimed
US-11066487-B2 Modified conjugated diene-based polymer and method of preparing the same LG CHEM, LTD. 2021-07-20 US claimed
US-11007807-B2 Printable recording media HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2021-05-18 US claimed
CN-108473621-B Modifier, modified conjugated diene polymer and preparation method thereof 株式会社LG化学 2021-01-12 CN claimed
CN-108473620-B Modified conjugated diene polymer and preparation method thereof 株式会社LG化学 2020-11-10 CN claimed
US-10450387-B2 Modifier, modified and conjugated diene-based polymer and methods for preparing them LG CHEM, LTD. (KR) 2019-10-22 US claimed
US-20180371113-A1 MODIFIER, MODIFIED AND CONJUGATED DIENE-BASED POLYMER AND METHODS FOR PREPARING THEM LG CHEM, LTD. (KR) 2018-12-27 US claimed
US-20180371114-A1 MODIFIED CONJUGATED DIENE-BASED POLYMER AND METHOD OF PREPARING THE SAME LG CHEM, LTD. (KR) 2018-12-27 US claimed
EP-3372622-A1 MODIFIED CONJUGATED DIENE-BASED POLYMER AND METHOD FOR PRODUCING SAME LG Chem, Ltd. (KR) 2018-09-12 EP claimed
EP-3357943-A1 MODIFIER AND MODIFIED CONJUGATED DIENE BASED POLYMER, AND PREPARATION METHODS THEREFOR LG Chem, Ltd. (KR) 2018-08-08 EP claimed
US-20080005852-A1 Durable multifunctional finishing of fabrics NANO-TEX, INC. 2008-01-10 US claimed
CN-101094890-A Processable filled, curable halogenated isoolefin elastomers EXXONMOBIL CHEM PATENTS INC (US) 2007-12-26 CN claimed
US-20070264208-A1 Cosmetic and/or pharmaceutical composition comprising at least one copolymer comprising at least one ionizable group, and cosmetic treatment process L'OREAL S.A. (FR) 2007-11-15 US claimed
EP-1797867-A1 Cosmetic or pharmaceutical composition comprising a copolymer containing at least one ionisable group, and cosmetic treatment L'Oréal (FR) 2007-06-20 EP claimed
EP-1793916-A1 COMPOSITE MATERIAL COMPRISING LAYERED HYDROPHILIC COATINGS McMaster University (CA) 2007-06-13 EP claimed
EP-1774085-A1 DURABLE TREATMENT FOR FABRICS Nano-Tex, Inc. (US) 2007-04-18 EP claimed
US-20060121217-A1 Composite material comprising layered hydrophilic coatings MCMASTER UNIVERSITY 2006-06-08 US claimed
WO-2006034575-A1 COMPOSITE MATERIAL COMPRISING LAYERED HYDROPHILIC COATINGS MCMASTER UNIVERSITY (CA) 2006-04-06 WO claimed
WO-2006015080-A1 DURABLE TREATMENT FOR FABRICS NANO-TEX, INC. (US) 2006-02-09 WO claimed
US-20060021150-A1 Durable treatment for fabrics NANO-TEX, INC. 2006-02-02 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 (3 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-11066487-B2 Modified conjugated diene-based polymer and method of preparing the same FDFT1, DCLRE1A, DYNLL1 TSHR 3609/4885HTR1A 3699/4885HTR6 4428/4885
US-20070264208-A1 Cosmetic and/or pharmaceutical composition comprising at least one copolymer comprising at least one ionizable group, and cosmetic treatment process KRT18, DSG1, DSC1 TSHR 3978/4885HTR1A 2170/4885HTR6 1714/4885
US-10450387-B2 Modifier, modified and conjugated diene-based polymer and methods for preparing them UFM1, F13A1, ITGAM TSHR 3508/4885HTR1A 3394/4885HTR6 3125/4885

“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.