SCHEMBL375551

SCHEMBL375551

Cc1c(C(=O)OCc2ccccc2)cc(-c2ccccc2)n1COCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.59
HPGD P15428 2/20 0.59
TSHR P16473 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
NPSR1 Q6W5P4 1/20 0.57
TP53 P04637 7/20 0.56
MEN1 O00255 2/20 0.55
GLA P06280 2/20 0.55
KMT2A Q03164 2/20 0.55
KDM4E B2RXH2 1/20 0.54
GAA P10253 1/20 0.52
LMNA P02545 4/20 0.52
MAPT P10636 3/20 0.48
POLB P06746 2/20 0.48

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
SCHEMBL23320065 0.71 HPGD (0.48) ALDH1A1HPGDTSHRSMN1; SMN2NPSR1
SCHEMBL2214489 0.71 NOTUM (0.70) ALDH1A1HPGDTSHRSMN1; SMN2NPSR1
SCHEMBL5922348 0.70 LMNA (0.69) ALDH1A1HPGDTSHRSMN1; SMN2NPSR1
SCHEMBL2588443 0.70 ALDH1A1 (0.72) ALDH1A1HPGDTSHRSMN1; SMN2KMT2A
SCHEMBL2213963 0.70 NPSR1 (0.70) ALDH1A1HPGDTSHRSMN1; SMN2NPSR1
SCHEMBL4432239 0.69 ALDH1A1 (0.50) ALDH1A1HPGDTSHRNPSR1KMT2A
SCHEMBL10414225 0.69 TSHR (0.60) ALDH1A1HPGDTSHRSMN1; SMN2NPSR1
SCHEMBL4574192 0.69 ALDH1A1 (0.67) ALDH1A1HPGDTSHRSMN1; SMN2NPSR1
SCHEMBL28369636 0.68 TDP1 (0.49) ALDH1A1HPGDTSHRSMN1; SMN2KMT2A
SCHEMBL50441 0.68 ALDH1A1 (0.89) ALDH1A1HPGDTSHRNPSR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8222274-B2 Pyrrole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2012-07-17 US disclosed
EP-1988075-B1 PYRROLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC (JP) 2012-01-25 EP disclosed
US-20090036421-A1 Pyrrole Derivative or Salt Thereof ASTELLAS PHARMA INC (JP) 2009-02-05 US disclosed
EP-1988075-A1 PYRROLE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2008-11-05 EP 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-20090036421-A1 Pyrrole Derivative or Salt Thereof HTR7, HTR2B, SSTR5 ALDH1A1 4209/4885HPGD 1353/4885TSHR 758/4885

“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.