SCHEMBL6405528

SCHEMBL6405528

O=C(N[C@@H](CO)Cc1ccccc1)C1(Sc2ccccc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.51
MAPK1 P28482 3/20 0.50
CYP3A4 P08684 1/20 0.50
ROCK2 O75116 5/20 0.43
ROCK1 Q13464 5/20 0.43
RPS6KA5 O75582 2/20 0.43
RPS6KA4 O75676 2/20 0.43
PRKACA P17612 2/20 0.43
GSK3B P49841 2/20 0.43
PRKX P51817 2/20 0.43
PRKG1 Q13976 2/20 0.43
CLK4 Q9HAZ1 2/20 0.43
GSK3A P49840 1/20 0.43
IRAK1 P51617 1/20 0.43
PKN2 Q16513 1/20 0.43
SGK2 Q9HBY8 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
PIN1 Q13526 1/20 0.40

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
SCHEMBL6412108 0.85 FPR3 (0.46) MMEMAPK1CYP3A4PIN1ALDH1A1
SCHEMBL1153618 0.80 MAPK1 (0.57) MMEMAPK1CYP3A4ROCK2ROCK1
SCHEMBL4965651 0.80 ECE1 (0.47) KMT2AACELMNA
SCHEMBL1152879 0.78 MME (0.61) MMEMAPK1CYP3A4ROCK2ROCK1
SCHEMBL1152668 0.78 MME (0.58) MMEMAPK1CYP3A4ROCK2ROCK1
SCHEMBL1153080 0.77 MME (0.60) MMEMAPK1CYP3A4ROCK2ROCK1
SCHEMBL4965656 0.76 ACACB (0.50) NPC1RAB9AKMT2ALMNAALDH1A1
SCHEMBL4962899 0.76 HPGD (0.38) MMECYP3A4KMT2ALMNACYP2C9
SCHEMBL4962001 0.75 SMN1; SMN2 (0.53) MAPK1CYP3A4NPC1RAB9AKMT2A
SCHEMBL3897966 0.73 MAPK1 (0.68) MMEMAPK1CYP3A4ROCK2ROCK1

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-20050288338-A1 Amido compounds and their use as pharmaceuticals INCYTE CORPORATION 2005-12-29 US claimed
US-20050288338-A1 Amido compounds and their use as pharmaceuticals INCYTE CORPORATION 2005-12-29 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 (1 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-20050288338-A1 Amido compounds and their use as pharmaceuticals HSD11B1, CYP11B1, HSD11B2 MME 342/4885MAPK1 829/4885CYP3A4 566/4885

“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.