SCHEMBL16202038

SCHEMBL16202038

Cc1nc(-c2ccc(Cl)cc2F)cn1C

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.46
HSD11B1 P28845 4/20 0.43
PDE10A Q9Y233 1/20 0.40
PDE2A O00408 3/20 0.38
LMNA P02545 1/20 0.38
GRIN2B Q13224 1/20 0.37
EGLN2 Q96KS0 1/20 0.37
CYP1B1 Q16678 1/20 0.36
GRM2 Q14416 2/20 0.35
CYP2C9 P11712 1/20 0.35
MAPK14 Q16539 1/20 0.35
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 1/20 0.35
BCHE P06276 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
SCHEMBL26096641 0.73 HSD11B1 (0.44) KMOHSD11B1EGLN2GRM2CYP2C9
SCHEMBL17436951 0.73 RAB9A (0.50) PDE10ALMNA
SCHEMBL2615815 0.71 CCR1 (0.48) KMOHSD11B1EGLN2GRM2CYP2C9
SCHEMBL18041687 0.71 CA2 (0.41) LMNA
SCHEMBL7707702 0.71 KMO (0.42) KMOHSD11B1PDE2AGRIN2BEGLN2
SCHEMBL26097001 0.70 TP53 (0.46) KMOHSD11B1GRM2CYP2C9
SCHEMBL31220949 0.69 HSD11B1 (0.39) KMOHSD11B1GRIN2BHSP90AA1HSP90AB1
SCHEMBL31220942 0.69 HSD11B1 (0.39) KMOHSD11B1GRIN2BHSP90AA1HSP90AB1
SCHEMBL2615352 0.69 KMO (0.43) KMOHSD11B1EGLN2CYP1B1GRM2
SCHEMBL6319050 0.69 KMO (0.43) KMOHSD11B1PDE2AGRIN2BEGLN2

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-20160249615-A1 Use of Strobilurin Type Compounds for Combating Phytopathogenic Fungi Resistant to QO Inhibitors BASF SE (DE) 2016-09-01 US disclosed
US-20160145219-A1 STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI BASF SE (DE) 2016-05-26 US disclosed
US-20160145202-A1 Strobilurin Type Compounds for Combating Phytopathogenic Fungi BASF SE (DE) 2016-05-26 US disclosed
US-20160122327-A1 STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI BASF SE (DE) 2016-05-05 US disclosed
US-9271501-B2 Use of strobilurin type compounds for combating phytopathogenic fungi resistant to QO inhibitors BASF SE (DE) 2016-03-01 US disclosed
US-20140323305-A1 Use of Strobilurin Type Compounds for Combating Phytopathogenic Fungi Resistant to QO Inhibitors BASF SE (DE) 2014-10-30 US 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 (5 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-20160122327-A1 STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI SNX1, DPM1, SNU13 KMO 3171/4885HSD11B1 2575/4885PDE10A 4878/4885
US-20160145219-A1 STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI DPM1, CROCC, SNX1 KMO 3843/4885HSD11B1 3412/4885PDE10A 4880/4885
US-20160145202-A1 Strobilurin Type Compounds for Combating Phytopathogenic Fungi DPM1, CROCC, SNX1 KMO 3843/4885HSD11B1 3412/4885PDE10A 4880/4885
US-20140323305-A1 Use of Strobilurin Type Compounds for Combating Phytopathogenic Fungi Resistant to QO Inhibitors SQOR, COX5B, UQCRB KMO 759/4885HSD11B1 1284/4885PDE10A 4786/4885
US-20160249615-A1 Use of Strobilurin Type Compounds for Combating Phytopathogenic Fungi Resistant to QO Inhibitors SQOR, COX5B, UQCRB KMO 759/4885HSD11B1 1284/4885PDE10A 4786/4885

“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.