SCHEMBL7522351

SCHEMBL7522351

CN(Cc1nc2ccccc2n1C)C(=O)OC(C)(C)C

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.54
USP2 O75604 1/20 0.54
HDAC6 Q9UBN7 1/20 0.53
MAPT P10636 2/20 0.52
TSHR P16473 3/20 0.47
TP53 P04637 1/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
RECQL P46063 1/20 0.44
CYP2D6 P10635 1/20 0.43
LMNA P02545 1/20 0.43
ACKR3 P25106 1/20 0.43

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
SCHEMBL22965254 0.81 LMNA (0.48) ALDH1A1SMN1; SMN2HDAC6MAPTTP53
SCHEMBL14847952 0.81 MAPT (0.48) ALDH1A1SMN1; SMN2USP2HDAC6MAPT
SCHEMBL940950 0.78 ALDH1A1 (0.37) ALDH1A1MAPT
SCHEMBL22965191 0.78 PTGDR2 (0.47) SMN1; SMN2MAPTTP53RECQLLMNA
SCHEMBL30466612 0.76 MAPT (0.70) ALDH1A1SMN1; SMN2HDAC6MAPTTSHR
SCHEMBL28366489 0.76 MAPT (0.70) ALDH1A1SMN1; SMN2HDAC6MAPTTSHR
SCHEMBL38661375 0.76 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2USP2HDAC6MAPT
SCHEMBL31504944 0.75 ACKR3 (0.53) ALDH1A1USP2HDAC6TSHRACKR3
SCHEMBL5610013 0.75 SMN1; SMN2 (0.68) ALDH1A1SMN1; SMN2USP2HDAC6MAPT
SCHEMBL14685205 0.75 SMN1; SMN2 (0.68) ALDH1A1SMN1; SMN2USP2HDAC6MAPT

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-20020032187-A1 Method for stimulating bone formation SMITHKLINE BEECHAM CORPORATION 2002-03-14 US disclosed
US-5977101-A Benzimidazoles/Imidazoles Linked to a Fibrinogen Receptor Antagonist Template Having Vitronectin Receptor Antagonist Activity SMITHKLINE BEECHAM CORPORATION (US) 1999-11-02 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-20020032187-A1 Method for stimulating bone formation BMP2, BMP4, SOST ALDH1A1 2599/4885SMN1; SMN2 3997/4885USP2 4418/4885

“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.