SCHEMBL16202073

SCHEMBL16202073

Cc1nn(-c2ccc(Cl)cc2)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.47
GPR55 Q9Y2T6 4/20 0.47
CNR2 P34972 3/20 0.47
GPR35 Q9HC97 1/20 0.47
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
KDM4E B2RXH2 3/20 0.44
NOTUM Q6P988 4/20 0.41
F2 P00734 1/20 0.41
GAA P10253 2/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
PKM P14618 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
KCNH2 Q12809 2/20 0.39
ADORA3 P0DMS8 2/20 0.39
ADORA2A P29274 1/20 0.39
PARP1 P09874 1/20 0.39
PARP2 Q9UGN5 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
SCHEMBL24185318 0.85 CNR1 (0.42) CNR1GPR55CNR2GPR35NPC1
SCHEMBL17963418 0.84 HPGD (0.47) CNR1GPR55CNR2GPR35NPC1
SCHEMBL16202074 0.84 CNR1 (0.47) CNR1GPR55CNR2GPR35NPC1
SCHEMBL9930636 0.81 NPC1 (0.46) CNR1GPR55CNR2GPR35NPC1
SCHEMBL718292 0.77 PTGS2 (0.45) CNR1GPR55CNR2GPR35NPC1
SCHEMBL11241844 0.77 KDM4E (0.49) CNR1GPR55CNR2GPR35NPC1
SCHEMBL7092105 0.76 KDM4E (0.47) CNR1GPR55CNR2GPR35NPC1
SCHEMBL6052366 0.75 NOTUM (0.49) NPC1RAB9AKDM4ENOTUMGAA
SCHEMBL7095866 0.74 KDM4E (0.50) CNR1GPR55CNR2GPR35NPC1
SCHEMBL3262911 0.74 NPC1 (0.41) CNR1GPR55CNR2GPR35NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 (3 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 CNR1 2619/4885GPR55 3573/4885CNR2 3667/4885
US-20160145202-A1 Strobilurin Type Compounds for Combating Phytopathogenic Fungi DPM1, CROCC, SNX1 CNR1 2619/4885GPR55 3573/4885CNR2 3667/4885
US-20140323305-A1 Use of Strobilurin Type Compounds for Combating Phytopathogenic Fungi Resistant to QO Inhibitors SQOR, COX5B, UQCRB CNR1 2770/4885GPR55 3255/4885CNR2 3732/4885

“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.