Tert-Butylamine

Tert-Butylamine

SCHEMBL3962778

CC(C)(C)N.CCCCN(Cc1ccc(C(F)(F)F)cc1)C(=O)COc1ccc(C[C@H](OCC)C(=O)O)cc1

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACEIDH1

The experimentally established mechanism targets of Tert-Butylamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.49
PPARG P37231 15/20 0.49
PPARD Q03181 8/20 0.49
TRPM8 Q7Z2W7 1/20 0.45
LTB4R2 Q9NPC1 1/20 0.42

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
SCHEMBL3959985 0.96 PPARA (0.52) PPARAPPARGPPARDTRPM8LTB4R2
SCHEMBL4898468 0.96 PPARA (0.52) PPARAPPARGPPARDTRPM8LTB4R2
SCHEMBL3964011 0.93 PPARA (0.51) PPARAPPARGPPARDTRPM8LTB4R2
Tert-Butylamine SCHEMBL3963133 0.91 TRPM8 (0.55) PPARAPPARGPPARDTRPM8
Tert-Butylamine SCHEMBL3963631 0.90 PPARA (0.47) PPARAPPARGPPARDTRPM8LTB4R2
SCHEMBL3962992 0.90 PPARA (0.52) PPARAPPARGPPARD
SCHEMBL3963050 0.89 PPARA (0.57) PPARAPPARGPPARDTRPM8
SCHEMBL3964001 0.88 TRPM8 (0.45) PPARAPPARGPPARDTRPM8LTB4R2
SCHEMBL3956914 0.88 PPARA (0.54) PPARAPPARGPPARD
SCHEMBL3962831 0.87 PPARA (0.49) PPARAPPARGPPARDLTB4R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7488844-B2 Therapeutic agents ASTRAZENECA AB (SE) 2009-02-10 US disclosed
US-7462644-B2 Therapeutic agents ASTRAZENECA AB (SE) 2008-12-09 US disclosed
US-20050282822-A1 Therapeutic agents ASTRAZENECA AB (SE) 2005-12-22 US disclosed
EP-1572626-A1 THERAPEUTIC AGENTS Astrazeneca AB (SE) 2005-09-14 EP disclosed
US-20050131068-A1 Therapeutic agents ASTRAZENECA AB (SE) 2005-06-16 US disclosed
WO-2004056748-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2004-07-08 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-20050131068-A1 Therapeutic agents GPR119, INSR, LIPA PPARA 539/4885PPARG 479/4885PPARD 698/4885
US-20050282822-A1 Therapeutic agents GPR119, LIPC, PNLIP PPARA 346/4885PPARG 228/4885PPARD 623/4885

“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.