SCHEMBL503613

SCHEMBL503613

COC(=O)Cc1c(C(=O)OC)c2cc(Oc3ccc(OC(C)C)cc3)ccc2n1-c1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.48
HTT P42858 3/20 0.48
HPGD P15428 3/20 0.48
MAPK1 P28482 2/20 0.48
PKM P14618 2/20 0.48
ALOX15 P16050 2/20 0.48
HSD17B10 Q99714 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TSHR P16473 2/20 0.48
KDM4E B2RXH2 4/20 0.48
GAA P10253 1/20 0.45
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 2/20 0.41
HIF1A Q16665 1/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.39

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
SCHEMBL503662 0.89 MAPT (0.44) MAPTHTTHPGDMAPK1PKM
SCHEMBL503848 0.89 MAPT (0.45) MAPTHTTHPGDMAPK1PKM
SCHEMBL333479 0.81 TP53 (0.52) MAPTHTTHPGDMAPK1PKM
SCHEMBL333757 0.81 KMT2A (0.56) MAPTHTTHPGDMAPK1PKM
SCHEMBL503637 0.79 MAPT (0.48) MAPTHTTHPGDMAPK1PKM
SCHEMBL333467 0.79 SMN1; SMN2 (0.44) MAPTSMN1; SMN2KDM4EKMT2AMEN1
SCHEMBL503724 0.78 MAPT (0.58) MAPTHTTHPGDMAPK1PKM
SCHEMBL333231 0.78 MEN1 (0.48) MAPTHTTHPGDMAPK1PKM
SCHEMBL333940 0.78 PTGES (0.44) MAPTSMN1; SMN2KMT2AMEN1POLB
SCHEMBL334099 0.78 ALOX5 (0.45) MAPTSMN1; SMN2KMT2AMEN1POLB

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-20120029016-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SW) 2012-02-02 US disclosed
WO-2010076566-A2 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2010-07-08 WO 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-20120029016-A1 Indoles Useful in the Treatment of Inflammation LTC4S, LTB4R2, LTB4R MAPT 3986/4885HTT 3222/4885HPGD 312/4885

“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.