SCHEMBL16202075

SCHEMBL16202075

Cc1cc(C(F)(F)F)n(-c2ccc(Cl)cc2)n1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.55
ORAI1 Q96D31 1/20 0.49
TP53 P04637 1/20 0.49
PTGS2 P35354 6/20 0.49
PTGS1 P23219 4/20 0.49
HTT P42858 2/20 0.48
SMN1; SMN2 Q16637 4/20 0.46
GAA P10253 3/20 0.46
HPGD P15428 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
THPO P40225 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44
HIF1A Q16665 1/20 0.44

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
SCHEMBL31503993 0.84 USP1 (0.43) POLBPTGS2PTGS1HTTSMN1; SMN2
SCHEMBL24185597 0.83 TP53 (0.50) TP53PTGS2PTGS1HTTSMN1; SMN2
SCHEMBL597566 0.83 ALDH1A1 (0.45) POLBORAI1TP53PTGS2PTGS1
SCHEMBL3281219 0.83 MAPK1 (0.56) PTGS1HTTSMN1; SMN2GAAHPGD
SCHEMBL13429415 0.83 ORAI1 (0.78) ORAI1TP53SMN1; SMN2GAAHPGD
SCHEMBL28236656 0.81 TRPC3 (0.48) ORAI1TP53PTGS2PTGS1HTT
SCHEMBL597455 0.81 LMNA (0.60) POLBPTGS2PTGS1HTTSMN1; SMN2
SCHEMBL16920744 0.80 ALDH1A1 (0.41) POLBORAI1TP53PTGS2PTGS1
SCHEMBL18865550 0.80 SLC34A1 (0.44) PTGS2PTGS1HTTSMN1; SMN2GAA
SCHEMBL3560066 0.80 ALDH1A1 (0.46) POLBORAI1TP53PTGS2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20140323305-A1 Use of Strobilurin Type Compounds for Combating Phytopathogenic Fungi Resistant to QO Inhibitors SQOR, COX5B, UQCRB POLB 198/4885ORAI1 4125/4885TP53 758/4885

“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.