SCHEMBL10287367

SCHEMBL10287367

OC1CCCc2ccc(F)nc21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.38
P2RX7 Q99572 1/20 0.34
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.32
NR3C1 P04150 1/20 0.32
KCNH2 Q12809 1/20 0.32
BRD3 Q15059 1/20 0.32
GRM5 P41594 3/20 0.31
DRD2 P14416 1/20 0.30
DRD1 P21728 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
SCHEMBL10286327 0.80 ACHE (0.39) ACHEP2RX7CYP11B1CYP11B2CYP1A2
SCHEMBL30484404 0.79 ACHE (0.38) ACHEP2RX7CYP1A2CYP2C9TSHR
SCHEMBL10287316 0.79 ACHE (0.41) ACHECYP1A2CYP2C9TSHRALDH1A1
SCHEMBL10287319 0.79 ACHE (0.38) ACHECYP1A2CYP2C9TSHRALDH1A1
SCHEMBL5111399 0.79 ACHE (0.38) ACHECYP1A2CYP2C9TSHRALDH1A1
SCHEMBL868218 0.79 ACHE (0.41) ACHECYP1A2CYP2C9TSHRALDH1A1
SCHEMBL29814887 0.79 ACHE (0.41) ACHECYP1A2CYP2C9TSHRALDH1A1
SCHEMBL4063983 0.79 ACHE (0.38) ACHEP2RX7CYP1A2CYP2C9TSHR
SCHEMBL14884981 0.79 ACHE (0.38) ACHECYP1A2CYP2C9TSHRALDH1A1
SCHEMBL14884980 0.79 ACHE (0.41) ACHECYP1A2CYP2C9TSHRALDH1A1

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-20220017541-A1 INHIBITORS OF ARGINASE Praxis Biotech LLC 2022-01-20 US disclosed
US-20130102631-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES SYNGENTA CROP PROTECTION LLC (US) 2013-04-25 US disclosed
US-20130102631-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES SYNGENTA CROP PROTECTION LLC (US) 2013-04-25 US disclosed
WO-2012001040-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2012-01-05 WO 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 (2 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-20220017541-A1 INHIBITORS OF ARGINASE ARG1, ARG2, ARGLU1 ACHE 402/4885P2RX7 3663/4885CYP11B1 1219/4885
US-20130102631-A1 NOVEL MICROBIOCIDAL DIOXIME ETHER DERIVATIVES MSR1, DDT, MPO ACHE 660/4885P2RX7 445/4885CYP11B1 738/4885

“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.