SCHEMBL6480036

SCHEMBL6480036

NC(=O)c1cc2ccc(C(=O)O)cc2o1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 2/20 0.47
NPC1 O15118 5/20 0.47
RAB9A P51151 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
TP53 P04637 1/20 0.47
PIM1 P11309 4/20 0.45
CSNK2A1 P68400 3/20 0.45
CSNK2A2 P19784 2/20 0.45
CSNK2B P67870 2/20 0.45
CSNK2A3 Q8NEV1 2/20 0.45
ITGB3 P05106 1/20 0.45
ITGA2B P08514 1/20 0.45
TSHR P16473 2/20 0.45
MAPK1 P28482 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
PRMT1 Q99873 1/20 0.42
MIF P14174 1/20 0.42
PLAU P00749 1/20 0.42
TTR P02766 2/20 0.41

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
SCHEMBL28044374 0.89 PIM1 (0.56) FLT3NPC1RAB9ASMN1; SMN2TP53
SCHEMBL6479262 0.86 PIM1 (0.53) FLT3NPC1RAB9ASMN1; SMN2TP53
SCHEMBL24138802 0.84 NPC1 (0.48) FLT3NPC1RAB9ASMN1; SMN2ITGB3
SCHEMBL6478966 0.84 SMN1; SMN2 (0.51) FLT3NPC1RAB9ASMN1; SMN2TP53
SCHEMBL6479111 0.80 PSMB8 (0.51) FLT3NPC1RAB9ASMN1; SMN2TP53
Isophthalic Acid SCHEMBL27887534 0.80 NPC1 (0.64) FLT3NPC1RAB9ASMN1; SMN2TP53
SCHEMBL28125380 0.80 KDM4E (0.46) FLT3NPC1RAB9ASMN1; SMN2TP53
SCHEMBL8716521 0.79 PRMT1 (0.59) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
Hydrochloric Acid SCHEMBL8713031 0.78 PRMT1 (0.58) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL10510996 0.78 FLT3 (0.76) FLT3NPC1RAB9ASMN1; SMN2TP53

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-6894042-B2 Azabicyclic compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY (US) 2005-05-17 US disclosed
EP-1476448-A2 AZABICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2004-11-17 EP disclosed
US-20040224976-A1 Azabicyclic compounds for the treatment of disease WALKER DANIEL PATRICK (US) 2004-11-11 US disclosed
US-20030232853-A1 Azabicyclic compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-18 US disclosed
WO-2003070731-A2 AZABICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2003-08-28 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 (2 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-20030232853-A1 Azabicyclic compounds for the treatment of disease TPMT, MALT1, AZI2 FLT3 824/4885NPC1 284/4885RAB9A 1279/4885
US-20040224976-A1 Azabicyclic compounds for the treatment of disease TPMT, MALT1, AZI2 FLT3 824/4885NPC1 284/4885RAB9A 1279/4885

“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.