SCHEMBL5700405

SCHEMBL5700405

CCCC/N=C(/NC(=O)C(C)(C)C)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
SCN5A Q14524 1/20 0.41
SCN2A Q99250 1/20 0.41
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP2D6 P10635 1/20 0.40
TSHR P16473 1/20 0.40
NAAA Q02083 1/20 0.40
ALDH1A1 P00352 2/20 0.40
RECQL P46063 1/20 0.40
CES2 O00748 3/20 0.40
CES1 P23141 3/20 0.40
POLB P06746 2/20 0.39
NPC1 O15118 1/20 0.39
ALOX12 P18054 1/20 0.39
RAB9A P51151 1/20 0.39
PRSS1 P07477 1/20 0.38

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
SCHEMBL5700407 1.00 LMNA (0.41) LMNASCN5ASCN2ACYP1A2CYP3A4
Hydrochloric Acid SCHEMBL5700353 0.97 LMNA (0.40) LMNASCN5ASCN2ACYP1A2CYP3A4
SCHEMBL5700582 0.91 SMN1; SMN2 (0.42) LMNASCN5ASCN2ACYP1A2CYP3A4
SCHEMBL5700585 0.91 SMN1; SMN2 (0.42) LMNASCN5ASCN2ACYP1A2CYP3A4
Hydrochloric Acid SCHEMBL5700596 0.89 SMN1; SMN2 (0.40) LMNASCN5ASCN2ACYP1A2CYP3A4
SCHEMBL5700600 0.86 SMN1; SMN2 (0.39) LMNASCN5ASCN2ACYP1A2CYP3A4
SCHEMBL3068165 0.74 NAAA (0.49) LMNASMN1; SMN2TSHRNAAAALDH1A1
SCHEMBL3068162 0.74 NAAA (0.49) LMNASMN1; SMN2TSHRNAAAALDH1A1
SCHEMBL975934 0.72 NAAA (0.42) SCN5ASCN2ANAAACES2CES1
SCHEMBL9645767 0.70 NAAA (0.55) SMN1; SMN2TSHRNAAAALDH1A1

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-7141687-B2 N'-substituted N-acylamidine metal transition complexes and their use as catalysts BASF AKTIENGESELLSCHAFT (DE) 2006-11-28 US disclosed
EP-1569947-B1 N'-SUBSTITUTED N-ACYLAMIDINE METAL TRANSITION COMPLEXES AND THEIR USE AS CATALYSTS BASF AG (DE) 2006-08-30 EP disclosed
US-20060069275-A1 N'-substituded n-acylamidine metal transition complexes and their use as catalysts BASF AKTIENGESELLSCHAFT (DE) 2006-03-30 US disclosed
EP-1569947-A1 N'-SUBSTITUTED N-ACYLAMIDINE METAL TRANSITION COMPLEXES AND THEIR USE AS CATALYSTS BASF AKTIENGESELLSCHAFT (DE) 2005-09-07 EP disclosed
WO-2004050670-A1 N'-SUBSTITUTED N-ACYLAMIDINE METAL TRANSITION COMPLEXES AND THEIR USE AS CATALYSTS BASF AKTIENGESELLSCHAFT (DE) 2004-06-17 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-20060069275-A1 N'-substituded n-acylamidine metal transition complexes and their use as catalysts NR1I3, NR0B1, NR4A1 LMNA 3888/4885SCN5A 1024/4885SCN2A 761/4885

“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.