SCHEMBL5757675

SCHEMBL5757675

CC(C)(C)OC(=O)NC(CBr)Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.47
AAK1 Q2M2I8 3/20 0.46
TSHR P16473 2/20 0.45
CTSL P07711 1/20 0.43
TACR1 P25103 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CTSS P25774 7/20 0.41
CTSK P43235 7/20 0.41
CTSB P07858 3/20 0.40
APP P05067 2/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
PNMT P11086 1/20 0.39
ACE P12821 1/20 0.39

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
SCHEMBL2550395 0.89 ATM (0.48) ATMAAK1TSHRCTSLTACR1
SCHEMBL2550398 0.89 ATM (0.48) ATMAAK1TSHRCTSLTACR1
SCHEMBL740615 0.86 ATM (0.49) ATMAAK1TSHRCTSLTACR1
SCHEMBL1519890 0.86 ATM (0.49) ATMAAK1TSHRCTSLTACR1
SCHEMBL740616 0.86 ATM (0.49) ATMAAK1TSHRCTSLTACR1
SCHEMBL5757441 0.86 ATM (0.53) ATMAAK1CTSLCTSSCTSK
SCHEMBL27228862 0.85 ATM (0.46) ATMAAK1TSHRCTSLTACR1
SCHEMBL27232277 0.85 ATM (0.46) ATMAAK1TSHRCTSLTACR1
SCHEMBL27228856 0.85 ATM (0.46) ATMAAK1TSHRCTSLTACR1
SCHEMBL6008671 0.84 CTSL (0.60) ATMAAK1CTSLCTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7078537-B2 Phenylalkyl diamine and amide analogs SK CORPORATION (KR) 2006-07-18 US disclosed
EP-1401821-A4 NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS SK CORP (KR) 2006-05-31 EP disclosed
EP-1401821-A1 NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS SK Corporation (KR) 2004-03-31 EP disclosed
US-20030105079-A1 Novel phenylalkyl diamine and amide analogs SK BIOPHARMACEUTICALS CO., LTD. (KR) 2003-06-05 US disclosed
WO-2002100848-A1 NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS SK CORPORATION (KR) 2002-12-19 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-20030105079-A1 Novel phenylalkyl diamine and amide analogs SIGMAR1, TAAR1, OPRL1 ATM 3190/4885AAK1 726/4885TSHR 276/4885

“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.