SCHEMBL7822889

SCHEMBL7822889

Cc1cccc(C(=O)Nc2ccc(C(=O)O)cc2)c1

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.78
KMT2A Q03164 7/20 0.78
NPC1 O15118 3/20 0.74
RAB9A P51151 3/20 0.74
TP53 P04637 2/20 0.74
KCNK3 O14649 8/20 0.71
KCNK9 Q9NPC2 4/20 0.71
KCNH2 Q12809 1/20 0.71
POLB P06746 1/20 0.69
FFAR1 O14842 2/20 0.69
GLA P06280 1/20 0.69
NT5E P21589 1/20 0.68
RXFP1 Q9HBX9 1/20 0.66
L3MBTL1 Q9Y468 2/20 0.64
PKM P14618 1/20 0.60
MAPT P10636 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
HPSE Q9Y251 1/20 0.59

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
SCHEMBL259666 0.88 KCNK3 (0.87) MEN1KMT2ANPC1RAB9ATP53
SCHEMBL30608967 0.88 KCNK3 (0.87) MEN1KMT2ANPC1RAB9ATP53
SCHEMBL30048093 0.88 NPC1 (0.81) MEN1KMT2ANPC1RAB9ATP53
SCHEMBL4257440 0.88 NPC1 (0.81) MEN1KMT2ANPC1RAB9ATP53
SCHEMBL9067770 0.88 KMT2A (1.00) MEN1KMT2ANPC1RAB9ATP53
SCHEMBL2077842 0.87 KCNK3 (0.81) MEN1KMT2ANPC1RAB9ATP53
SCHEMBL8734134 0.87 KCNK3 (0.76) MEN1KMT2ANPC1RAB9ATP53
SCHEMBL2058359 0.86 KMT2A (0.96) MEN1KMT2ANPC1RAB9ATP53
SCHEMBL12259175 0.86 POLB (0.76) MEN1KMT2ANPC1RAB9ATP53
Hydrochloric Acid SCHEMBL2105161 0.86 KCNK3 (0.79) MEN1KMT2ANPC1RAB9ATP53

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
US-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2007-11-29 US disclosed
US-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2007-11-29 US disclosed
CN-1314906-A Salts of paroxetine SMITHKLINE BEECHAM PLC (GB) 2001-09-26 CN disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 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-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 MEN1 2892/4885KMT2A 2948/4885NPC1 3368/4885

“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.