SCHEMBL5414288

SCHEMBL5414288

O=C(O)C1C(=O)N=c2ccccc2=C1O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
POLB P06746 2/20 0.35
MAPT P10636 6/20 0.34
ALDH1A1 P00352 3/20 0.34
LMNA P02545 2/20 0.34
PKM P14618 1/20 0.34
MAPK10 P53779 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TGM2 P21980 1/20 0.33
ATM Q13315 1/20 0.32
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
CTSL P07711 1/20 0.32
ALPI P09923 1/20 0.32
ALPG P10696 1/20 0.32
CCR6 P51684 1/20 0.31
KDR P35968 1/20 0.31
RAB9A P51151 1/20 0.31
SLC6A3 Q01959 1/20 0.31

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
SCHEMBL27669692 0.66 TSHR (0.33) POLBMAPTALDH1A1LMNANPSR1
Isatin SCHEMBL7073534 0.63 MAPT (0.47) KMT2AMEN1POLBMAPTALDH1A1
Isatin SCHEMBL30956357 0.62 MAPT (0.46) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL16150631 0.62 MAPT (0.40) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL6065515 0.61 CES2 (0.37) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL8521194 0.60 KMT2A (0.44) KMT2AMEN1POLBMAPTALDH1A1
Bicarbonate SCHEMBL9542773 0.60 NPSR1 (0.39) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL28101622 0.59 MAPT (0.41) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL1137916 0.59 MAPT (0.40) KMT2AMEN1POLBMAPTALDH1A1
SCHEMBL8591954 0.59 MAPT (0.46) KMT2AMAPTALDH1A1LMNAMAPK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7271179-B2 Inhibitors of JAK protein kinase VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-09-18 US claimed
JP-2006513192-A 2006-04-20 JP claimed
CN-1665808-A Thiadiazoles or oxadiazoles and their use as inhibitors of JAK protein kinase VERTEX PHARMA (US) 2005-09-07 CN claimed
EP-1501829-A1 THIADIAZOLES OR OXADIAZOLES AND THEIR USE AS INHIBITORS OF JAK PROTEIN KINASE Vertex Pharmaceuticals Incorporated (US) 2005-02-02 EP claimed
WO-2004058753-A1 THIADIAZOLES OR OXADIAZOLES AND THEIR USE AS INHIBITORS OF JAK PROTEIN KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2004-07-15 WO claimed
US-20040038992-A1 Inhibitors of Jak protein kinase VERTEX PHARMACEUTICALS INCORPORATED 2004-02-26 US claimed
US-7271179-B2 Inhibitors of JAK protein kinase VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-09-18 US disclosed
EP-1501829-A1 THIADIAZOLES OR OXADIAZOLES AND THEIR USE AS INHIBITORS OF JAK PROTEIN KINASE Vertex Pharmaceuticals Incorporated (US) 2005-02-02 EP disclosed
WO-2004058753-A1 THIADIAZOLES OR OXADIAZOLES AND THEIR USE AS INHIBITORS OF JAK PROTEIN KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2004-07-15 WO disclosed
US-20040038992-A1 Inhibitors of Jak protein kinase VERTEX PHARMACEUTICALS INCORPORATED 2004-02-26 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-20040038992-A1 Inhibitors of Jak protein kinase JAK2, JAK1, JAK3 KMT2A 1098/4885MEN1 2739/4885POLB 2847/4885

“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.