SCHEMBL2377288

SCHEMBL2377288

CN(C(=O)OC(C)(C)C)C1CCC(Oc2cc(F)ccc2[N+](=O)[O-])CC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.40
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.38
FAAH O00519 1/20 0.37
ACHE P22303 1/20 0.37
KMT2A Q03164 1/20 0.36
GPR119 Q8TDV5 2/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
SNCA P37840 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL2377283 1.00 RAB9A (0.40) RAB9AMAPTALDH1A1FAAHACHE
SCHEMBL2380026 1.00 RAB9A (0.40) RAB9AMAPTALDH1A1FAAHACHE
SCHEMBL16908833 0.94 GPR119 (0.39) RAB9AMAPTALDH1A1FAAHACHE
SCHEMBL2391387 0.94 GPR119 (0.39) RAB9AMAPTALDH1A1FAAHACHE
SCHEMBL2394209 0.89 GPR119 (0.38) RAB9AMAPTALDH1A1FAAHACHE
SCHEMBL2393071 0.88 ALDH1A1 (0.42) RAB9AMAPTALDH1A1FAAHACHE
SCHEMBL2393067 0.88 ALDH1A1 (0.42) RAB9AMAPTALDH1A1FAAHACHE
SCHEMBL2473269 0.86 FAAH (0.41) RAB9AMAPTALDH1A1FAAHACHE
SCHEMBL2392995 0.86 ALDH1A1 (0.46) RAB9AMAPTALDH1A1FAAHACHE
SCHEMBL2473272 0.86 FAAH (0.41) RAB9AMAPTALDH1A1FAAHACHE

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
EP-2539345-B1 4-[CYCLOALKYLOXY(HETERO)ARYLAMINO]-THIENO[2,3-D]PYRIMIDINES HAVING MNK1/ MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INT (DE) 2015-07-22 EP disclosed
US-8754079-B2 Cycloalkyl containing thienopyrimidines for pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-06-17 US disclosed
EP-2539345-A1 4 - [CYCLOALKYLOXY (HETERO) ARYLAMINO]THIENO [2, 3 - D]PYRIMIDINES HAVING MNKL/ MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS Boehringer Ingelheim International GmbH (DE) 2013-01-02 EP disclosed
US-20110217311-A1 CYCLOALKYL CONTAINING THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-09-08 US disclosed
WO-2011104334-A1 4 - [CYCLOALKYLOXY (HETERO) ARYLAMINO] THIENO [2, 3 - D] PYRIMIDINES HAVING MNKL/ MNK2 INHIBITING ACTIVITY FOR PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-09-01 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-20110217311-A1 CYCLOALKYL CONTAINING THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DTYMK, CMPK1, UCK2 RAB9A 2511/4885MAPT 2378/4885ALDH1A1 4123/4885

“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.