SCHEMBL123635

SCHEMBL123635

O=C1CC(=O)N(c2ccccc2)C(=O)N1CC(F)(F)F

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.42
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
GAA P10253 3/20 0.41
MAPT P10636 3/20 0.41
USP2 O75604 2/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PKM P14618 1/20 0.41
TLR9 Q9NR96 1/20 0.41
ALDH1A1 P00352 3/20 0.39
ENPP2 Q13822 1/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
OPRK1 P41145 2/20 0.37
PDE4D Q08499 1/20 0.37
NR1I2 O75469 1/20 0.36

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
SCHEMBL17717923 0.82 MEN1 (0.56) HPGDMEN1KMT2AGAAMAPT
SCHEMBL5443739 0.79 HPGD (0.46) HPGDMEN1KMT2AGAAMAPT
SCHEMBL17717965 0.78 MAPT (0.62) HPGDMEN1KMT2AGAAMAPT
SCHEMBL2680328 0.78 MEN1 (0.62) HPGDMEN1KMT2AGAAMAPT
SCHEMBL437784 0.77 HPGD (0.59) HPGDMEN1KMT2AGAAMAPT
SCHEMBL11750989 0.76 MEN1 (0.50) HPGDMEN1KMT2AGAAMAPT
SCHEMBL9496590 0.76 MEN1 (0.50) HPGDMEN1KMT2AGAAMAPT
SCHEMBL11652238 0.76 MEN1 (0.50) HPGDMEN1KMT2AGAAMAPT
SCHEMBL9181777 0.75 HPGD (0.42) HPGDMEN1KMT2AGAAMAPT
SCHEMBL11651629 0.75 KMT2A (0.76) HPGDMEN1KMT2AGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120059163-A1 Non-linear opticaly active molecules, their synthesis, and use OPTIMER PHOTONICS, INC. (US) 2012-03-08 US disclosed
US-20120059163-A1 Non-linear opticaly active molecules, their synthesis, and use OPTIMER PHOTONICS, INC. (US) 2012-03-08 US disclosed
US-20080004415-A1 Non-linear optically active molecules, their synthesis, and use OPTIMER PHOTONICS, INC. (US) 2008-01-03 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-20120059163-A1 Non-linear opticaly active molecules, their synthesis, and use INCENP, CYBA, ADCY5 HPGD 215/4885MEN1 4480/4885KMT2A 3041/4885
US-20080004415-A1 Non-linear optically active molecules, their synthesis, and use INCENP, CYBA, PAICS HPGD 264/4885MEN1 4473/4885KMT2A 2961/4885

“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.