SCHEMBL6740290

SCHEMBL6740290

Cc1c(C(F)(F)F)cnc(Cl)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.38
MBOAT4 Q96T53 1/20 0.32
XPO1 O14980 3/20 0.31
CYP1A2 P05177 2/20 0.31
LRRK2 Q5S007 2/20 0.31
RPS6KA5 O75582 1/20 0.31
AR P10275 1/20 0.31
ASPH Q12797 1/20 0.31
P2RX7 Q99572 1/20 0.31
COMT P21964 1/20 0.31
HSD11B1 P28845 1/20 0.30

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
SCHEMBL31214152 0.85 PIK3CD (0.39) PIK3CDMBOAT4XPO1CYP1A2LRRK2
SCHEMBL23664435 0.83 MBOAT4 (0.32) PIK3CDMBOAT4CYP1A2LRRK2AR
SCHEMBL6740078 0.82 PIK3CD (0.37) PIK3CDMBOAT4XPO1CYP1A2LRRK2
SCHEMBL7047809 0.80 PIK3CD (0.41) PIK3CDXPO1CYP1A2LRRK2RPS6KA5
SCHEMBL6742485 0.80 COMT (0.35) CYP1A2LRRK2ARASPHP2RX7
SCHEMBL30631544 0.80 PIK3CD (0.36) PIK3CDMBOAT4XPO1CYP1A2LRRK2
SCHEMBL26608178 0.80 PIK3CD (0.36) PIK3CDMBOAT4XPO1CYP1A2LRRK2
SCHEMBL29930638 0.80 COMT (0.35) CYP1A2LRRK2ARASPHP2RX7
SCHEMBL21606876 0.80 PIK3CD (0.36) PIK3CDMBOAT4AR
Hydrochloric Acid SCHEMBL27573305 0.79 PIK3CD (0.35) PIK3CDMBOAT4AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040043903-A1 Herbicides; applying to plants BASF AKTIENGESELLSCHAFT (DE) 2004-03-04 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-20040043903-A1 Herbicides; applying to plants DDT, DRD1, DRD4 PIK3CD 2752/4885MBOAT4 4086/4885XPO1 2192/4885

“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.