SCHEMBL224549

SCHEMBL224549

NCCc1ccccc1CCN

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 10/20 0.70
HTR2A P28223 5/20 0.68
CYP2A6 P11509 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
LOXL2 Q9Y4K0 1/20 0.55
HRH1 P35367 2/20 0.54
MPO P05164 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
NFKB1 P19838 1/20 0.48
HTR1D P28221 1/20 0.48
HTR1B P28222 1/20 0.48
HTR2C P28335 1/20 0.48
HTR7 P34969 1/20 0.48
CTSK P43235 1/20 0.48
HTR6 P50406 1/20 0.48
CYP2A13 Q16696 1/20 0.48
PMP22 Q01453 1/20 0.46
HMGB1 P09429 1/20 0.45

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
SCHEMBL3051426 0.91 TAAR1 (0.61) TAAR1HTR2ACYP2A6SMN1; SMN2LOXL2
SCHEMBL6314758 0.91 HTR2A (0.74) TAAR1HTR2ACYP2A6SMN1; SMN2LOXL2
SCHEMBL6638715 0.87 TAAR1 (0.56) TAAR1HTR2ACYP2A6SMN1; SMN2LOXL2
SCHEMBL2907330 0.87 TAAR1 (0.60) TAAR1HTR2ACYP2A6SMN1; SMN2LOXL2
SCHEMBL10862161 0.87 TAAR1 (0.67) TAAR1HTR2ACYP2A6SMN1; SMN2LOXL2
SCHEMBL6875195 0.87 TAAR1 (0.60) TAAR1HTR2ACYP2A6SMN1; SMN2LOXL2
SCHEMBL3057797 0.87 TAAR1 (0.60) TAAR1HTR2ACYP2A6SMN1; SMN2LOXL2
SCHEMBL10414028 0.87 TAAR1 (0.62) TAAR1HTR2ACYP2A6SMN1; SMN2LOXL2
SCHEMBL18653966 0.87 TAAR1 (0.60) TAAR1HTR2ACYP2A6SMN1; SMN2LOXL2
SCHEMBL28597876 0.87 TAAR1 (0.56) TAAR1HTR2ACYP2A6SMN1; SMN2LOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4107223-A1 LOW DENSITY FLAME RETARDANT TWO-COMPONENT COMPOSITION FOR STRUCTURAL VOID FILLING Zephyros Inc. (US) 2022-12-28 EP claimed
US-9862798-B2 Epoxy liquid curing agent compositions EVONIK DEGUSSA GMBH (DE) 2018-01-09 US claimed
EP-3052541-A1 EPOXY LIQUID CURING AGENT COMPOSITIONS Air Products and Chemicals, Inc. (US) 2016-08-10 EP claimed
US-20150094400-A1 Epoxy Liquid Curing Agent Compositions AIR PRODUCTS AND CHEMICALS INC. (US) 2015-04-02 US claimed
WO-2015048701-A1 EPOXY LIQUID CURING AGENT COMPOSITIONS AIR PRODUCTS AND CHEMICALS, INC. (US) 2015-04-02 WO claimed
EP-2090571-B1 Pyrimidine derivates, medicaments comprising them, their use and process of their preparation BOEHRINGER INGELHEIM PHARMA (DE) 2012-05-16 EP claimed
EP-2332924-A1 Pyrimidine derivates, medicaments comprising them, their use and process of their preparation Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2011-06-15 EP claimed
JP-4460292-B2 2010-05-12 JP claimed
US-7709480-B2 Pyrimidine derivatives BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2010-05-04 US claimed
EP-1438053-B1 PYRIMIDINE DERIVATIVES, PHARMACEUTICAL AGENT CONTAINING SAID COMPOUNDS, USE AND METHOD FOR MAKING SAME BOEHRINGER INGELHEIM PHARMA (DE) 2008-09-10 EP claimed
US-20030171359-A1 Suitable for treatment of illnesses characterised by excessive or abnormal cell proliferation; viral, bacterial, fungal and/or parasitic infections, skin diseases, bone diseases, cardiovascular diseases BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-09-11 US claimed
WO-2003032997-A1 PYRIMIDINE DERIVATIVES, PHARMACEUTICAL AGENT CONTAINING SAID COMPOUNDS, USE AND METHOD FOR MAKING SAME BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-04-24 WO claimed
EP-0955318-A1 Gels derived from extending grafted alpha-olefin-maleimide centipede polymers and polypropylene Bridgestone Corporation (JP) 1999-11-10 EP claimed
EP-0955316-A1 Gels derived from extending grafted centipede polymers and polypropylene Bridgestone Corporation (JP) 1999-11-10 EP claimed
EP-0955319-A1 Soft compounds derived from polypropylene grafted disubstituted ethylene-maleimide copolymers Bridgestone Corporation (JP) 1999-11-10 EP claimed
EP-0955317-A1 Grafted maleimide-styrene-g-polypropylene copolymers used in rubber compounds for increasing hysteresis Bridgestone Corporation (JP) 1999-11-10 EP claimed
EP-0879832-A1 High damping gel derived from extending grafted elastomers and polypropylene Bridgestone Corporation (JP) 1998-11-25 EP claimed
EP-0879831-A1 An extended polymer composition derived from grafted elastomers and polypropylene Bridgestone Corporation (JP) 1998-11-25 EP claimed
US-5646209-A Thermoplastic resin composition comprising liquid crystalline polyester, aromatic polycarbonate and glass fiber SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-08 US claimed
EP-0441545-A1 Two-component curable hot-melt resin compositions Union Camp Corporation (US) 1991-08-14 EP 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 (1 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-20030171359-A1 Suitable for treatment of illnesses characterised by excessive or abnormal cell proliferation; viral, bacterial, fungal and/or parasitic infections, skin diseases, bone diseases, cardiovascular diseases COL1A1, MKI67, INSR TAAR1 498/4885HTR2A 3506/4885CYP2A6 485/4885

“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.