SCHEMBL4226915

SCHEMBL4226915

Cc1ccc(NC(=O)Nc2ccc(-c3ccc(C(=O)CC(C)(C)C(=O)O)cc3)cc2)cc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.50
NPC1 O15118 4/20 0.50
KMT2A Q03164 3/20 0.50
MEN1 O00255 1/20 0.50
CCNC P24863 1/20 0.47
CDK8 P49336 1/20 0.47
ALDH1A1 P00352 3/20 0.46
POLB P06746 3/20 0.46
NAMPT P43490 1/20 0.44
ROCK2 O75116 1/20 0.43
MAP4K4 O95819 1/20 0.43
LCK P06239 1/20 0.43
RET P07949 1/20 0.43
PIM1 P11309 1/20 0.43
RPS6KB1 P23443 1/20 0.43
KDR P35968 1/20 0.43
GSK3B P49841 1/20 0.43
BLK P51451 1/20 0.43
PRKCD Q05655 1/20 0.43
PRKAA1 Q13131 1/20 0.43

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
SCHEMBL5151064 0.88 KMT2A (0.46) RAB9ANPC1KMT2AMEN1CCNC
SCHEMBL5071427 0.88 DGAT1 (0.44) RAB9ANPC1KMT2AMEN1POLB
SCHEMBL13752563 0.83 NPC1 (0.54) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL5067991 0.82 RAB9A (0.50) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL3100283 0.80 RAB9A (0.56) RAB9ANPC1KMT2AMEN1CCNC
SCHEMBL4110295 0.78 RAB9A (0.56) RAB9ANPC1KMT2AMEN1CCNC
SCHEMBL4226768 0.77 NPC1 (0.52) RAB9ANPC1KMT2AMEN1POLB
SCHEMBL4226568 0.74 RAB9A (0.47) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL13752572 0.73 RAB9A (0.58) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL6032026 0.73 SMN1; SMN2 (0.39) RAB9ANPC1KMT2AMEN1ALDH1A1

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-1874317-A2 PREPARATION AND USE OF ARYL ALKYL ACID DERIVATIVES FOR THE TREATMENT OF OBESITY Bayer Pharmaceuticals Corporation (US) 2008-01-09 EP claimed
WO-2006113919-A2 ARYL ALKYL ACID DERIVATIVES FOR AND USE THEREOF BAYER PHARMACEUTICALS CORPORATION (US) 2006-10-26 WO claimed
US-20090215780-A1 Preparation and Use of Aryl Alkyl Acid Derivatives for the Treatment of Obesity BAYER PHARMACEUTICALS CORPORATION (US) 2009-08-27 US disclosed
US-20090215780-A1 Preparation and Use of Aryl Alkyl Acid Derivatives for the Treatment of Obesity BAYER PHARMACEUTICALS CORPORATION (US) 2009-08-27 US disclosed
US-20090215780-A1 Preparation and Use of Aryl Alkyl Acid Derivatives for the Treatment of Obesity BAYER PHARMACEUTICALS CORPORATION (US) 2009-08-27 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-20090215780-A1 Preparation and Use of Aryl Alkyl Acid Derivatives for the Treatment of Obesity FABP4, GPR119, LIPC RAB9A 2066/4885NPC1 187/4885KMT2A 627/4885

“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.