SCHEMBL15314031

SCHEMBL15314031

CCC(O)CCN1CCOCC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.52
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 3/20 0.45
TSHR P16473 1/20 0.44
GLA P06280 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KEAP1 Q14145 1/20 0.41
HPGD P15428 1/20 0.38
DUSP3 P51452 1/20 0.38

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
SCHEMBL5825218 0.86 USP2 (0.50) USP2ALDH1A1KDM4ETSHRGLA
SCHEMBL15187311 0.83 USP2 (0.47) USP2ALDH1A1KDM4ETSHRGLA
SCHEMBL15187251 0.83 USP2 (0.47) USP2ALDH1A1KDM4ETSHRGLA
SCHEMBL734049 0.82 USP2 (0.72) USP2ALDH1A1KDM4ETSHRGLA
SCHEMBL12349244 0.82 USP2 (0.54) USP2ALDH1A1KDM4ETSHRGLA
SCHEMBL15314029 0.81 MEN1 (0.44) ALDH1A1KDM4E
SCHEMBL25299334 0.81 USP2 (0.52) USP2ALDH1A1KDM4ETSHRGLA
SCHEMBL1453895 0.81 USP2 (0.52) USP2ALDH1A1KDM4ETSHRGLA
SCHEMBL9729323 0.80 USP2 (0.52) USP2ALDH1A1KDM4ETSHRGLA
SCHEMBL22539919 0.79 USP2 (0.47) USP2ALDH1A1KDM4EGLASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170348320-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE AMBIT BIOSCIENCES CORP (US) 2017-12-07 US disclosed
US-20150126505-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE AMBIT BIOSCIENCES CORP (US) 2015-05-07 US disclosed
US-8921546-B2 Imidazolothiazole compounds for the treatment of disease AMBIT BIOSCIENCES CORPORATION (US) 2014-12-30 US disclosed
US-20140243525-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE AMBIT BIOSCIENCES CORPORATION (US) 2014-08-28 US disclosed
US-8557810-B2 Imidazolothiazole compounds for the treatment of disease AMBIT BIOSCIENCES CORPORATION (US) 2013-10-15 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 (3 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-20150126505-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE GRK2, GRK4, GRK3 USP2 2802/4885ALDH1A1 3704/4885KDM4E 4443/4885
US-20140243525-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE GRK2, GRK4, GRK3 USP2 2802/4885ALDH1A1 3704/4885KDM4E 4443/4885
US-20170348320-A1 IMIDAZOLOTHIAZOLE COMPOUNDS FOR THE TREATMENT OF DISEASE GRK2, GRK4, GRK3 USP2 2802/4885ALDH1A1 3704/4885KDM4E 4443/4885

“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.