SCHEMBL20186979

SCHEMBL20186979

Cc1ccc(CS(=O)(=O)Nc2ccc(C#N)c(Br)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 1/20 0.48
BRPF1 P55201 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
RORC P51449 3/20 0.39
CYP19A1 P11511 1/20 0.39
GAA P10253 1/20 0.38
PGR P06401 1/20 0.38
NAMPT P43490 1/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
SLC22A12 Q96S37 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.37
KMT2A Q03164 1/20 0.37
HPGD P15428 1/20 0.36

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
SCHEMBL20186964 0.87 IMPDH2 (0.50) IMPDH2BRPF1HDAC1HDAC8HDAC6
SCHEMBL20187005 0.85 SLC22A12 (0.54) IMPDH2BRPF1GAANPC1ALDH1A1
SCHEMBL20186969 0.85 IMPDH2 (0.48) IMPDH2RORCCYP19A1GAAPGR
SCHEMBL20186975 0.82 IMPDH2 (0.48) IMPDH2HDAC8PGRALDH1A1SLC22A12
SCHEMBL20186966 0.82 POLB (0.41) IMPDH2BRPF1HDAC1HDAC8HDAC6
SCHEMBL20186980 0.81 SLC22A12 (0.54) IMPDH2RORCPGRSLC22A12
SCHEMBL31284484 0.81 IMPDH2 (0.46) IMPDH2BRPF1HDAC1HDAC8HDAC6
SCHEMBL20186993 0.81 IMPDH2 (0.46) IMPDH2BRPF1HDAC1HDAC8HDAC6
SCHEMBL20187004 0.81 IMPDH2 (0.46) IMPDH2BRPF1HDAC1HDAC8HDAC6
SCHEMBL20186967 0.81 IMPDH2 (0.45) IMPDH2PGRSLC22A12

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-10905120-B2 ABA receptor agonists that modulate transpiration THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-02-02 US disclosed
US-20180146666-A1 ABA RECEPTOR AGONISTS THAT MODULATE TRANSPIRATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-05-31 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 (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-10905120-B2 ABA receptor agonists that modulate transpiration ADORA2A, ADORA1, AAK1 IMPDH2 2394/4885BRPF1 1004/4885HDAC1 2967/4885
US-20180146666-A1 ABA RECEPTOR AGONISTS THAT MODULATE TRANSPIRATION ADORA2A, ADORA1, AAK1 IMPDH2 2394/4885BRPF1 1004/4885HDAC1 2967/4885

“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.