SCHEMBL289704

SCHEMBL289704

Cc1nc(-c2ccc(-c3cccs3)cc2)sc1C(=O)O

nearest known ligand 0.79

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.79
SMN1; SMN2 Q16637 5/20 0.68
RAB9A P51151 5/20 0.67
GAA P10253 3/20 0.67
NPC1 O15118 2/20 0.63
POLB P06746 1/20 0.63
ALDH1A1 P00352 7/20 0.59
TARBP2 Q15633 1/20 0.53
HPGD P15428 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
MAPT P10636 2/20 0.50
KMT2A Q03164 2/20 0.50
XDH P47989 1/20 0.50
PPARG P37231 1/20 0.47
NCOA2 Q15596 1/20 0.47
NCOA1 Q15788 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
LMNA P02545 1/20 0.47
ATM Q13315 1/20 0.47

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
SCHEMBL3418775 0.88 KDM4E (1.00) KDM4ESMN1; SMN2RAB9AGAANPC1
SCHEMBL288846 0.83 KDM4E (0.84) KDM4ESMN1; SMN2RAB9AGAANPC1
SCHEMBL290099 0.83 KDM4E (0.81) KDM4ESMN1; SMN2RAB9AGAANPC1
SCHEMBL289248 0.82 KDM4E (0.77) KDM4ESMN1; SMN2RAB9AGAANPC1
SCHEMBL289112 0.82 SMN1; SMN2 (0.93) KDM4ESMN1; SMN2RAB9AGAANPC1
SCHEMBL1327631 0.82 SMN1; SMN2 (1.00) KDM4ESMN1; SMN2RAB9AGAANPC1
SCHEMBL892234 0.81 RAB9A (1.00) KDM4ESMN1; SMN2RAB9AGAANPC1
SCHEMBL3328924 0.79 SMN1; SMN2 (0.76) KDM4ESMN1; SMN2RAB9AGAANPC1
SCHEMBL2011167 0.79 RAB9A (0.79) KDM4ESMN1; SMN2RAB9AGAANPC1
SCHEMBL8867051 0.79 RAB9A (0.79) KDM4ESMN1; SMN2RAB9AGAANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427447-A2 SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION Pike Pharma GmbH (CH) 2012-03-14 EP disclosed
WO-2010128163-A2 SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION PIKE PHARMA GMBH (CH) 2010-11-11 WO disclosed
US-7687664-B2 Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-30 US disclosed
US-20040214888-A1 Carboxylic acid derivative and medicine comprising salt or ester of the same EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-10-28 US disclosed
EP-1394147-A1 CARBOXYLIC ACID DERIVATIVE AND MEDICINE COMPRISING SALT OR ESTER OF THE SAME Eisai Co., Ltd. (JP) 2004-03-03 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-20040214888-A1 Carboxylic acid derivative and medicine comprising salt or ester of the same GPR119, NR3C1, INSR KDM4E 3724/4885SMN1; SMN2 2879/4885RAB9A 3699/4885

“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.