SCHEMBL7923049

SCHEMBL7923049

[CH2]Oc1ccn(-c2ccc(Cl)cc2)n1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 9/20 0.49
NOTUM Q6P988 5/20 0.43
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
F2 P00734 1/20 0.39
PKM P14618 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 2/20 0.35
UBE2N P61088 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL7923011 0.81 SIGMAR1 (0.49) SIGMAR1NOTUMALDH1A1CYP1A2CYP3A4
SCHEMBL7923053 0.81 SIGMAR1 (0.49) SIGMAR1NOTUMALDH1A1CYP1A2CYP3A4
SCHEMBL7757989 0.81 CYP2C9 (0.43) NOTUMALDH1A1LMNAMAPTL3MBTL1
SCHEMBL28966719 0.81 SIGMAR1 (0.56) SIGMAR1NOTUMALDH1A1CYP1A2CYP3A4
SCHEMBL17764753 0.77 APOBEC3G (0.36) SIGMAR1ALDH1A1L3MBTL1KDM4E
SCHEMBL28276549 0.77 SIGMAR1 (0.46) SIGMAR1NOTUMALDH1A1CYP1A2CYP3A4
SCHEMBL17764744 0.77 SIGMAR1 (0.43) SIGMAR1
SCHEMBL29554825 0.76 ALDH1A1 (0.47) SIGMAR1NOTUMALDH1A1CYP1A2CYP3A4
SCHEMBL31432743 0.75 SIGMAR1 (0.60) SIGMAR1ALDH1A1CYP1A2CYP3A4
SCHEMBL28826934 0.75 ALDH1A1 (0.46) SIGMAR1NOTUMALDH1A1CYP1A2CYP3A4

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-6221808-B1 Method for controlling parasitic fungi in cultivated plants BASF AKTIENGESELLSCHAFT (DE) 2001-04-24 US claimed
US-20160145219-A1 STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI BASF SE (DE) 2016-05-26 US disclosed
CN-103609575-B A kind of bactericidal composition containing tetramycin and pyraclostrobin HAILIR PESTICIDES AND CHEMICALS GROUP CO.,LTD. (CN) 2016-01-20 CN disclosed
CN-103609575-A Bactericidal composition containing tetramycin and pyraclostrobin HAILIR PESTICIDES & CHEM GROUP 2014-03-05 CN disclosed
CN-103355333-A Sterilization composition containing pyraclostrobin and boscalid HAILIR PESTICIDES & CHEM GROUP 2013-10-23 CN 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-20160145219-A1 STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI DPM1, CROCC, SNX1 SIGMAR1 3846/4885NOTUM 2527/4885ALDH1A1 3309/4885

“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.