SCHEMBL17140997

SCHEMBL17140997

CC(C)(C)OC(=O)N1CCC(Nc2cccc(Cl)c2)(C(N)=O)CC1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 6/20 0.48
JAK1 P23458 6/20 0.48
STS P08842 3/20 0.48
ANO1 Q5XXA6 1/20 0.46
PARP14 Q460N5 1/20 0.45
LMNA P02545 1/20 0.44
MKNK1 Q9BUB5 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GPR119 Q8TDV5 1/20 0.40

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
SCHEMBL17140944 0.82 JAK2 (0.49) JAK2JAK1STSANO1MKNK1
SCHEMBL12315513 0.80 SMN1; SMN2 (0.47) JAK2JAK1LMNAMEN1KMT2A
SCHEMBL17140741 0.80 FPR2 (0.50) JAK2JAK1GPR119
SCHEMBL10447211 0.79 TSHR (0.48) JAK2JAK1STSANO1MEN1
SCHEMBL31158334 0.79 TSHR (0.48) JAK2JAK1STSANO1MEN1
SCHEMBL17140943 0.79 ALDH1A1 (0.58) JAK2JAK1STSLMNAGPR119
SCHEMBL4224081 0.78 GPR119 (0.45) JAK2JAK1PARP14GPR119
SCHEMBL17140641 0.78 JAK2 (0.55) JAK2JAK1GPR119
SCHEMBL18940716 0.78 JAK2 (0.51) JAK2JAK1MEN1KMT2AGPR119
SCHEMBL20236163 0.77 MEN1 (0.66) STSPARP14LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190225611-A1 SUBSTITUTED SPIROCYCLIC INHIBITORS OF AUTOTAXIN X-RX, INC. 2019-07-25 US disclosed
US-10233182-B2 Substituted spirocyclic inhibitors of autotaxin X-RX, INC. (US) 2019-03-19 US disclosed
US-20180282332-A1 SUBSTITUTED SPIROCYCLIC INHIBITORS OF AUTOTAXIN X-RX, INC. 2018-10-04 US disclosed
US-10011601-B2 Substituted spirocyclic inhibitors of autotaxin X-RX, INC. (US) 2018-07-03 US disclosed
US-20170166568-A1 SUBSTITUTED SPIROCYCLIC INHIBITORS OF AUTOTAXIN X-RX, INC. (US) 2017-06-15 US disclosed
US-20170166568-A1 SUBSTITUTED SPIROCYCLIC INHIBITORS OF AUTOTAXIN X-RX, INC. (US) 2017-06-15 US disclosed
EP-3125895-A1 SUBSTITUTED SPIROCYDIC INHIBITORS OF AUTOTAXIN X-RX, Inc. (US) 2017-02-08 EP disclosed
WO-2015154023-A1 SUBSTITUTED SPIROCYDIC INHIBITORS OF AUTOTAXIN X-RX DISCOVERY, INC. (US) 2015-10-08 WO disclosed
WO-2015154023-A1 SUBSTITUTED SPIROCYDIC INHIBITORS OF AUTOTAXIN X-RX DISCOVERY, INC. (US) 2015-10-08 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 (5 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-20170166568-A1 SUBSTITUTED SPIROCYCLIC INHIBITORS OF AUTOTAXIN ENPP2, SLC10A1, CXCR3 JAK2 507/4885JAK1 2138/4885STS 545/4885
US-10233182-B2 Substituted spirocyclic inhibitors of autotaxin ENPP2, CXCR3, SLC10A1 JAK2 499/4885JAK1 2671/4885STS 428/4885
US-20180282332-A1 SUBSTITUTED SPIROCYCLIC INHIBITORS OF AUTOTAXIN ENPP2, CXCR3, SLC10A1 JAK2 499/4885JAK1 2671/4885STS 428/4885
US-20190225611-A1 SUBSTITUTED SPIROCYCLIC INHIBITORS OF AUTOTAXIN ENPP2, SLC10A1, CXCR3 JAK2 507/4885JAK1 2138/4885STS 545/4885
US-10011601-B2 Substituted spirocyclic inhibitors of autotaxin ENPP2, SLC10A1, CXCR3 JAK2 507/4885JAK1 2138/4885STS 545/4885

“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.