SCHEMBL5872473

SCHEMBL5872473

CC(C)C[C@H](N)C(c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 4/20 0.47
TAAR1 Q96RJ0 3/20 0.45
ADRA2A P08913 1/20 0.43
ADRA2C P18825 1/20 0.43
LMNA P02545 1/20 0.43
HIF1A Q16665 1/20 0.43
KDM4E B2RXH2 1/20 0.43
DPP4 P27487 2/20 0.42
F2 P00734 1/20 0.42
ALDH1A1 P00352 1/20 0.42
AOC3 Q16853 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
SCHEMBL1169086 1.00 TACR1 (0.47) TACR1TAAR1ADRA2AADRA2CLMNA
SCHEMBL28906870 0.83 TAAR1 (0.45) TAAR1ADRA2AADRA2CLMNAHIF1A
SCHEMBL9449194 0.79 ADRA2C (0.61) ADRA2AADRA2CLMNAHIF1AKDM4E
SCHEMBL6743516 0.79 ADRA2C (0.61) ADRA2AADRA2CLMNAHIF1AKDM4E
SCHEMBL26923438 0.77 TACR1 (0.50) TACR1TAAR1ADRA2AADRA2CLMNA
SCHEMBL13995085 0.77 TAAR1 (0.48) TAAR1ADRA2AADRA2CLMNAHIF1A
SCHEMBL6856102 0.77 TAAR1 (0.48) TAAR1ADRA2AADRA2CLMNAHIF1A
SCHEMBL5914545 0.77 TAAR1 (0.48) TAAR1ADRA2AADRA2CLMNAHIF1A
SCHEMBL28004002 0.77 TACR1 (0.46) TACR1TAAR1ADRA2AADRA2CLMNA
SCHEMBL6743358 0.76 THRB (0.46) TAAR1ADRA2AADRA2CLMNAHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3768659-B1 AN IMPROVED ASYMMETRIC SYNTHESIS OF ALPHA-(DIARYLMETHYL) ALKYL AMINES PIRAMAL PHARMA LTD (IN) 2023-07-19 EP disclosed
US-11279668-B2 Asymmetric synthesis of alpha-(diarylmethyl) alkyl amines PIRAMAL PHARMA LIMITED (IN) 2022-03-22 US disclosed
US-20210061752-A1 AN IMPROVED ASYMMETRIC SYNTHESIS OF alpha-(DIARYLMETHYL) ALKYL AMINES Piramal Enterprises Limited (IN) 2021-03-04 US disclosed
EP-3768659-A1 AN IMPROVED ASYMMETRIC SYNTHESIS OF ALPHA-(DIARYLMETHYL) ALKYL AMINES Piramal Pharma Limited (IN) 2021-01-27 EP disclosed
WO-2019180627-A1 AN IMPROVED ASYMMETRIC SYNTHESIS OF alpha-(DIARYLMETHYL) ALKYL AMINES Piramal Enterprises Limited (IN) 2019-09-26 WO disclosed
US-7126028-B1 Process for preparing chiral compounds THE UNIVERSITY COURT OF THE UNIVERSITY OF ST. ANDREWS (GB) 2006-10-24 US disclosed
EP-1135349-A1 PROCESS FOR PREPARING CHIRAL COMPOUNDS UNIVERSITY OF DURHAM (GB) 2001-09-26 EP disclosed
WO-2000034210-A1 PROCESS FOR PREPARING CHIRAL COMPOUNDS UNIVERSITY OF DURHAM (GB) 2000-06-15 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 (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-20210061752-A1 AN IMPROVED ASYMMETRIC SYNTHESIS OF alpha-(DIARYLMETHYL) ALKYL AMINES SAT1, BET1, SRM TACR1 2688/4885TAAR1 103/4885ADRA2A 451/4885
US-11279668-B2 Asymmetric synthesis of alpha-(diarylmethyl) alkyl amines SAT1, SRM, SMS TACR1 2246/4885TAAR1 73/4885ADRA2A 348/4885

“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.