SCHEMBL14677261

SCHEMBL14677261

O=C(NC1C2CN(C(=O)O)CC21)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
EPHX2 P34913 1/20 0.47
FABP5 Q01469 3/20 0.43
FABP7 O15540 2/20 0.43
MDM4 O15151 1/20 0.43
TP53 P04637 1/20 0.43
CASP3 P42574 2/20 0.43
OPRD1 P41143 1/20 0.43
DPP8 Q6V1X1 1/20 0.42
DPP9 Q86TI2 1/20 0.42

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
SCHEMBL14678450 0.84 BACE1 (0.46) KMT2AEPHX2MDM4TP53
SCHEMBL29569298 0.84 BACE1 (0.46) KMT2AEPHX2MDM4TP53
SCHEMBL14677677 0.81 KMT2A (0.53) KMT2AEPHX2FABP5FABP7MDM4
SCHEMBL1721964 0.80 KMT2A (0.43) KMT2AEPHX2FABP5FABP7MDM4
SCHEMBL17438457 0.78 ALDH1A1 (0.53)
SCHEMBL17438458 0.78 ALDH1A1 (0.53)
SCHEMBL17438456 0.78 ALDH1A1 (0.53)
SCHEMBL1256624 0.77 KMT2A (0.58) KMT2AEPHX2FABP5FABP7MDM4
SCHEMBL4726879 0.77 KMT2A (0.45) KMT2AEPHX2FABP5FABP7MDM4
SCHEMBL3219970 0.76 FABP5 (0.49) KMT2AEPHX2FABP5FABP7OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220056038-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF KARYOPHARM THERAPEUTICS INC (US) 2022-02-24 US disclosed
US-20200087313-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF Karyopharm Therapeutics Inc. 2020-03-19 US disclosed
EP-2736883-B1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF KARYOPHARM THERAPEUTICS INC (US) 2019-09-04 EP disclosed
US-20170137430-A1 Nuclear Transport Modulators And Uses Thereof KARYOPHARM THERAPEUTICS INC (US) 2017-05-18 US disclosed
US-9428490-B2 Nuclear transport modulators and uses thereof Karyopharm Therapeutics Inc. (US) 2016-08-30 US disclosed
EP-2736883-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF Karyopharm Therapeutics, Inc. (US) 2014-06-04 EP disclosed
WO-2013019561-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF KARYOPHARM THERAPEUTICS, INC. (US) 2013-02-07 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 (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-20170137430-A1 Nuclear Transport Modulators And Uses Thereof XPO1, XPO5, XPOT KMT2A 3078/4885EPHX2 4623/4885FABP5 2629/4885
US-20200087313-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF XPO1, XPO5, XPOT KMT2A 3078/4885EPHX2 4623/4885FABP5 2629/4885
US-20220056038-A1 NUCLEAR TRANSPORT MODULATORS AND USES THEREOF XPO1, XPO5, XPOT KMT2A 3078/4885EPHX2 4623/4885FABP5 2629/4885

“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.