SCHEMBL6741064

SCHEMBL6741064

CCc1ccc2[nH]c(C(=O)OCc3ccccc3)cc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.56
RAB9A P51151 5/20 0.56
ALDH1A1 P00352 4/20 0.56
HPGD P15428 4/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
HSD17B10 Q99714 2/20 0.56
HRH3 Q9Y5N1 1/20 0.55
NPC1 O15118 2/20 0.54
LMNA P02545 2/20 0.54
MAPT P10636 2/20 0.54
ATM Q13315 2/20 0.54
MEN1 O00255 1/20 0.54
GLA P06280 1/20 0.54
GAA P10253 1/20 0.54
KMT2A Q03164 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C9 P11712 1/20 0.54
SRD5A2 P31213 1/20 0.54
HTT P42858 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL3559031 0.87 KDM4E (0.52) KDM4ERAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL7681707 0.87 ALDH1A1 (0.71) KDM4ERAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL12042750 0.85 KDM4E (0.49) KDM4ERAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL29481857 0.85 KDM4E (0.49) KDM4ERAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL12042752 0.85 KDM4E (0.50) KDM4ERAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL6512775 0.85 HRH3 (0.71) KDM4ERAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL30741601 0.85 IDO1 (0.61) KDM4ERAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL3964905 0.85 IDO1 (0.61) KDM4ERAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL829242 0.85 KDM4E (0.76) KDM4ERAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL8694126 0.84 ATM (0.59) KDM4EALDH1A1HPGDHSD17B10HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040043995-A1 Novel triazole derivatives, process for their preparation and pharmaceutical compositions containing them BIGNON ERIC (FR) 2004-03-04 US disclosed
US-6380230-B1 FOR THERAPY OF DYSKINESIA, OBESITY, IRRITABLE BOWEL SYNDROME, DISEASES WHOSE TREATMENT REQUIRES STIMULATION OF THE CHOLECYSTOKININ CCK-A RECEPTORS SANOFI-SYNTHELABO (FR) 2002-04-30 US disclosed
CN-1276790-A Carboxamidothiazole derivs., preparation, pharmaceutical composition contg. them SANOFI SA (FR) 2000-12-13 CN disclosed
CN-1263528-A N-triazolyl-2-indolecarboxamides and their use in CCK-A agonists SANOFI SYNTHELABO (FR) 2000-08-16 CN 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-20040043995-A1 Novel triazole derivatives, process for their preparation and pharmaceutical compositions containing them CCKAR, CCKBR, NPY1R KDM4E 1971/4885RAB9A 1127/4885ALDH1A1 2097/4885

“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.