SCHEMBL3149265

SCHEMBL3149265

[CH2]COCc1cc(C(F)(F)F)ccc1F

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 7/20 0.63
PDE2A O00408 2/20 0.35
USP30 Q70CQ3 2/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
TDO2 P48775 1/20 0.34
TACR1 P25103 1/20 0.34
MRGPRX4 Q96LA9 1/20 0.34
P2RX7 Q99572 1/20 0.34
BACE1 P56817 1/20 0.33

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
SCHEMBL3156002 0.86 IDO1 (0.63) IDO1PDE2ATACR1
SCHEMBL147418 0.80 IDO1 (0.58) IDO1PDE2AUSP30CA1CA2
SCHEMBL3153617 0.79 TACR1 (0.46) IDO1TACR1
SCHEMBL3162264 0.78 IDO1 (0.41) IDO1CA9TACR1
SCHEMBL5041166 0.78 IDO1 (0.56) IDO1USP30MRGPRX4
SCHEMBL18602429 0.74 IDO1 (0.59) IDO1PDE2AUSP30CA1CA2
SCHEMBL20303666 0.72 IDO1 (0.58) IDO1PDE2ACA1CA2CA9
SCHEMBL14255640 0.72 IDO1 (0.58) IDO1PDE2AUSP30MRGPRX4BACE1
SCHEMBL1167122 0.72 IDO1 (0.58) IDO1PDE2AUSP30CA1CA2
SCHEMBL268985 0.72 IDO1 (0.58) IDO1PDE2AUSP30CA1CA2

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-20100081693-A1 THIADIAZOLE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-01 US disclosed
CN-101516878-A Thiadiazole compound and use thereof SUMITOMO CHEMICAL CO (JP) 2009-08-26 CN disclosed
EP-2061789-A2 THIADIAZOLE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2009-05-27 EP disclosed
WO-2008032858-A2 THIADIAZOLE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-03-20 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 (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-20100081693-A1 THIADIAZOLE COMPOUND AND USE THEREOF NR2C2, NR4A3, NR0B2 IDO1 1716/4885PDE2A 3220/4885USP30 2927/4885

“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.