SCHEMBL6479768

SCHEMBL6479768

Cc1nnnn1Cc1c(Cl)ccc(C(=O)OC2=CC(=O)CCC2)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.33
BUB1 O43683 1/20 0.32
MAPT P10636 1/20 0.32
CCR1 P32246 1/20 0.32
CCR2 P41597 1/20 0.32
MAPK1 P28482 1/20 0.31
RORC P51449 2/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
HPGD P15428 1/20 0.30
CYP2C19 P33261 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
SCHEMBL6324155 0.83 BUB1 (0.32) BUB1MAPT
SCHEMBL6481018 0.83 HPD (0.31) MAPTCYP1A2CYP2C9HPGDCYP2C19
SCHEMBL6482084 0.83 ENPP2 (0.34) BUB1
SCHEMBL6480430 0.82 P2RX7 (0.40) P2RX7BUB1MAPTCCR1CCR2
SCHEMBL28542686 0.82 FAAH (0.34) BUB1RORC
SCHEMBL6482302 0.80 MAPK1 (0.33) MAPK1CYP1A2CYP2C9
SCHEMBL6331565 0.79 BUB1 (0.31) BUB1
SCHEMBL6332854 0.79 ROCK2 (0.33)
SCHEMBL5184258 0.79 ALDH1A1 (0.40) MAPTHPGD
SCHEMBL6481163 0.78 POLB (0.33)

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-20050090398-A1 Novel tetrazole derivative useful as herbicides YANAGI AKIHIKO (JP) 2005-04-28 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-20050090398-A1 Novel tetrazole derivative useful as herbicides DDT, TTI1, CYP1A1 P2RX7 1507/4885BUB1 1179/4885MAPT 3026/4885

“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.