SCHEMBL318688

SCHEMBL318688

CC(C)(C)OC(=O)n1c(=O)n(CCCCl)c2cc(Cl)ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.41
GABRG2 P18507 3/20 0.39
GABRB3 P28472 3/20 0.39
GABRA5 P31644 3/20 0.39
GABRA1 P14867 2/20 0.39
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C9 P11712 2/20 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
SCHEMBL639520 0.83 LMNA (0.46) LMNAL3MBTL1SMN1; SMN2GABRG2GABRB3
SCHEMBL642619 0.76 LMNA (0.51) LMNAL3MBTL1SMN1; SMN2GABRG2GABRB3
SCHEMBL639940 0.74 ALDH1A1 (0.42) LMNAL3MBTL1SMN1; SMN2GABRG2GABRB3
SCHEMBL641168 0.73 LMNA (0.57) LMNAL3MBTL1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL25232659 0.73 MEN1 (0.43) LMNAL3MBTL1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL642977 0.71 LMNA (0.44) LMNAL3MBTL1SMN1; SMN2GABRG2GABRB3
SCHEMBL30336999 0.71 CCR2 (0.55) LMNAL3MBTL1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL25232919 0.71 CCR2 (0.55) LMNAL3MBTL1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL18171783 0.71 ALDH1A1 (0.46) LMNAL3MBTL1SMN1; SMN2GABRG2GABRB3
SCHEMBL31709387 0.70 ALDH1A1 (0.43) ALDH1A1KDM4EHPGDNR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3138841-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC (US) 2017-03-08 EP disclosed
US-9156840-B2 D2 antagonists, methods of synthesis and methods of use Altos Therapeutics, LLC (US) 2015-10-13 US disclosed
US-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-11-27 US disclosed
EP-2582701-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC (US) 2013-04-24 EP disclosed
US-20120010228-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC 2012-01-12 US disclosed
WO-2011160084-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC (US) 2011-12-22 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 (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-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE DRD2, DRD3, AVPR2 LMNA 4596/4885L3MBTL1 2998/4885SMN1; SMN2 3145/4885
US-20120010228-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE DRD2, DRD3, AVPR2 LMNA 4596/4885L3MBTL1 2998/4885SMN1; SMN2 3145/4885

“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.