SCHEMBL2390198

SCHEMBL2390198

O=C(O)c1ccc(N2CCC(NC(=O)C34CC5CC(CC(C5)C3)C4)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.53
KMT2A Q03164 3/20 0.52
MEN1 O00255 1/20 0.52
EPHX2 P34913 2/20 0.52
USP2 O75604 1/20 0.51
RAB9A P51151 1/20 0.49
HPGDS O60760 1/20 0.47
ALDH1A1 P00352 3/20 0.46
LMNA P02545 1/20 0.46
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
SRD5A2 P31213 1/20 0.46
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL2384645 0.83 EPHX2 (0.51) EPHX1KMT2AMEN1EPHX2RAB9A
SCHEMBL2384471 0.76 ALDH1A1 (0.77) KMT2AMEN1ALDH1A1LMNASRD5A2
SCHEMBL15560163 0.75 SMYD3 (0.59) KMT2AMEN1USP2RAB9AHPGDS
SCHEMBL4142873 0.74 CNR1 (0.54) EPHX1KMT2AMEN1RAB9AALDH1A1
SCHEMBL8351812 0.74 USP2 (0.69) KMT2AMEN1USP2RAB9AHPGDS
SCHEMBL2389057 0.73 ALDH1A1 (0.60) KMT2AMEN1USP2ALDH1A1LMNA
SCHEMBL27889141 0.73 ALDH1A1 (0.58) KMT2AEPHX2USP2RAB9AHPGDS
SCHEMBL2386636 0.73 USP2 (0.51) EPHX1KMT2AMEN1EPHX2USP2
SCHEMBL28826584 0.72 EPHX1 (0.67) EPHX1KMT2AMEN1EPHX2RAB9A
SCHEMBL19172948 0.72 EPHX2 (0.71) EPHX1KMT2AMEN1EPHX2ALDH1A1

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
EP-2757105-A1 Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases Abbvie Inc. (US) 2014-07-23 EP disclosed
EP-2550258-A2 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES Abbvie Inc. (US) 2013-01-30 EP disclosed
US-8343967-B2 Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBOTT LABORATORIES (US) 2013-01-01 US disclosed
US-20120214796-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC. 2012-08-23 US disclosed
US-8188077-B2 Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBOTT LABORATORIES (US) 2012-05-29 US disclosed
WO-2011119345-A2 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBOTT LABORATORIES (US) 2011-09-29 WO disclosed
US-20110237553-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBOTT LABORATORIES (US) 2011-09-29 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 (2 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-20120214796-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BCL2, BAX, BCL3 EPHX1 3977/4885KMT2A 3558/4885MEN1 3502/4885
US-20110237553-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BCL2, BAX, BCL3 EPHX1 3977/4885KMT2A 3558/4885MEN1 3502/4885

“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.