SCHEMBL6771706

SCHEMBL6771706

CN(C)CCc1ccccc1-c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.60
HTR7 P34969 4/20 0.58
DPP4 P27487 1/20 0.50
ADRB2 P07550 1/20 0.46
ADRB1 P08588 1/20 0.46
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
FOLH1 Q04609 1/20 0.45
PDCD1 Q15116 1/20 0.44
CD274 Q9NZQ7 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
HTR2A P28223 3/20 0.44
HTR2C P28335 2/20 0.44
HTR1A P08908 1/20 0.43

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
SCHEMBL11246005 0.87 SIGMAR1 (0.55) TAAR1HTR7DPP4ADRB2ADRB1
SCHEMBL11060982 0.85 CD274 (0.61) TAAR1HTR7ADRB2ADRB1KDM4E
Hydrochloric Acid SCHEMBL9952490 0.85 SIGMAR1 (0.53) TAAR1HTR7DPP4ADRB2ADRB1
SCHEMBL6048555 0.81 SRC (0.52) TAAR1HTR7HTR2AHTR2CHTR1A
SCHEMBL11333152 0.80 DPP4 (0.65) HTR7DPP4ALDH1A1FOLH1PDCD1
Hydrochloric Acid SCHEMBL6048546 0.80 SRC (0.51) TAAR1HTR7HTR2AHTR2CHTR1A
Hydrogen Sulfide SCHEMBL27761134 0.79 HTR1A (0.49) HTR7DPP4PDCD1CD274CA12
SCHEMBL3464186 0.79 DPP4 (0.54) TAAR1HTR7DPP4KDM4EALDH1A1
SCHEMBL6048510 0.79 HTR2A (0.56) TAAR1HTR7HTR2AHTR2CHTR1A
Hydrochloric Acid SCHEMBL6048492 0.78 HTR2A (0.55) TAAR1HTR7HTR2AHTR2CHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6710080-B2 ANALGESICS GRUENENTHAL GMBH (DE) 2004-03-23 US claimed
JP-2003506426-A 2003-02-18 JP claimed
US-20020198251-A1 Substituted 2-dialkylaminoalkylbiphenyl derivatives GRUENENTHAL GMBH (DE) 2002-12-26 US claimed
CN-1379755-A Substituted 2-Dialkylaminoalkylbiphenyl Derivatives GRUENTHAL GMBH (DE) 2002-11-13 CN claimed
EP-1202953-A2 SUBSTITUTED 2-DIALKYLAMINOALKYLBIPHENYL DERIVATIVES Grünenthal GmbH (DE) 2002-05-08 EP claimed
WO-2001010816-A2 SUBSTITUTED 2-DIALKYLAMINOALKYLBIPHENYL DERIVATIVES Grünenthal GmbH (DE) 2001-02-15 WO claimed
US-4473709-A Pyrethroid intermediates and process FMC CORPORATION (US) 1984-09-25 US claimed
CN-1245376-C Substituted 2-Dialkylaminoalkylbiphenyl Derivatives GRUENTHAL GMBH (DE) 2006-03-15 CN disclosed
US-6710080-B2 ANALGESICS GRUENENTHAL GMBH (DE) 2004-03-23 US disclosed
US-20020198251-A1 Substituted 2-dialkylaminoalkylbiphenyl derivatives GRUENENTHAL GMBH (DE) 2002-12-26 US disclosed
CN-1379755-A Substituted 2-Dialkylaminoalkylbiphenyl Derivatives GRUENTHAL GMBH (DE) 2002-11-13 CN disclosed
EP-1202953-A2 SUBSTITUTED 2-DIALKYLAMINOALKYLBIPHENYL DERIVATIVES Grünenthal GmbH (DE) 2002-05-08 EP disclosed
WO-2001010816-A2 SUBSTITUTED 2-DIALKYLAMINOALKYLBIPHENYL DERIVATIVES Grünenthal GmbH (DE) 2001-02-15 WO 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 (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-20020198251-A1 Substituted 2-dialkylaminoalkylbiphenyl derivatives LIPA, PKD1, PKD2 TAAR1 3902/4885HTR7 501/4885DPP4 6/4885

“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.