SCHEMBL19075697

SCHEMBL19075697

CCCCC(CC)C(=O)Nc1ccc2ccn(Cc3ccc(C(=O)NCC(=O)O)cc3C)c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
EPHX2 P34913 2/20 0.43
NR1H4 Q96RI1 2/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.36
PPARG P37231 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
GAA P10253 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL19083763 0.90 EPHX2 (0.57) LMNAEPHX2NR1H4MEN1KMT2A
SCHEMBL8998273 0.79 EPHX2 (0.66) LMNAEPHX2NR1H4MEN1KMT2A
SCHEMBL10561346 0.78 EPHX2 (0.57) LMNAEPHX2NR1H4MEN1KMT2A
SCHEMBL9491290 0.77 EPHX2 (0.55) LMNAEPHX2NR1H4CA1CA2
SCHEMBL9493566 0.76 EPHX2 (0.51) LMNAEPHX2NR1H4MEN1KMT2A
SCHEMBL19083765 0.76 EPHX2 (0.53) EPHX2NR1H4PPARG
SCHEMBL9479093 0.76 EPHX2 (0.53) EPHX2NR1H4PPARG
SCHEMBL9478351 0.75 EPHX2 (0.52) LMNAEPHX2NR1H4MEN1KMT2A
SCHEMBL9479106 0.75 EPHX2 (0.51) LMNAEPHX2NR1H4MEN1KMT2A
SCHEMBL9478572 0.75 LMNA (0.42) LMNAEPHX2NR1H4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10005724-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2018-06-26 US disclosed
US-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-07-06 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-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 LMNA 462/4885EPHX2 952/4885NR1H4 529/4885
US-10005724-B2 Therapeutic compounds and methods of use thereof RDX, C1R, MTX1 LMNA 462/4885EPHX2 952/4885NR1H4 529/4885

“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.