SCHEMBL5128683

SCHEMBL5128683

CC(C)C(=O)N(C)Cc1ccc(Cl)nc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.43
AGTR2 P50052 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ATM Q13315 1/20 0.42
HPGD P15428 1/20 0.41
POLB P06746 1/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
MLYCD O95822 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
SCHEMBL3326164 0.83 ALDH1A1 (0.51) ALDH1A1RAB9ANPC1AGTR2MEN1
SCHEMBL14007030 0.83 ALDH1A1 (0.55) ALDH1A1RAB9ANPC1AGTR2MEN1
SCHEMBL5128302 0.82 ALDH1A1 (0.44) ALDH1A1LMNAAGTR2MEN1KMT2A
SCHEMBL14540444 0.79 TAS2R14 (0.46) ALDH1A1NPC1LMNAMEN1KMT2A
SCHEMBL30131234 0.79 ALDH1A1 (0.62) ALDH1A1RAB9ANPC1LMNAMEN1
SCHEMBL14540447 0.78 KCNH2 (0.45) LMNAHPGDMLYCD
SCHEMBL17202936 0.76 ALDH1A1 (0.47) ALDH1A1LMNAMEN1KMT2AATM
SCHEMBL13040797 0.76 ALDH1A1 (0.47) ALDH1A1LMNAMEN1KMT2AATM
SCHEMBL19501406 0.76 MEN1 (0.54) ALDH1A1RAB9ANPC1LMNAMEN1
SCHEMBL14641819 0.76 SMN1; SMN2 (0.44) ALDH1A1LMNAMEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7417150-B2 Azoles having an insecticidal action BAYER CROPSCIENCE AG (DE) 2008-08-26 US disclosed
CN-1312138-C Novel azoles having an insecticidal action BAYER AG (DE) 2007-04-25 CN disclosed
EP-1383751-B1 NOVEL AZOLES HAVING AN INSECTICIDAL ACTION BAYER CROPSCIENCE AG (DE) 2007-01-17 EP disclosed
CN-1250533-C Novel insecticidal pyrrole compounds BAYER CROPSCIENCE AG (DE) 2006-04-12 CN disclosed
CN-1690051-A Novel azoles having an insecticidal action BAYER AG (DE) 2005-11-02 CN disclosed
US-20050009839-A1 Novel azoles having an insecticidal action BAYER CROPSCIENCE AG (DE) 2005-01-13 US disclosed
CN-1503788-A Novel insecticidal pyrrole compounds �ݶ�ũ�����ѧ�ɷݹ�˾ 2004-06-09 CN disclosed
EP-1383751-A1 NOVEL AZOLES HAVING AN INSECTICIDAL ACTION Bayer CropScience AG (DE) 2004-01-28 EP disclosed
WO-2002085870-A1 NOVEL AZOLES HAVING AN INSECTICIDAL ACTION BAYER CROPSCIENCE AG (DE) 2002-10-31 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-20050009839-A1 Novel azoles having an insecticidal action CYP51A1, DDT, CRY1 ALDH1A1 3099/4885RAB9A 836/4885NPC1 1714/4885

“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.