SCHEMBL5582770

SCHEMBL5582770

CN(C)CCNC(=O)Cc1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 9/20 0.64
SMN1; SMN2 Q16637 3/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
HTT P42858 1/20 0.56
ABL1 P00519 7/20 0.53
RIN1 Q13671 7/20 0.53
CYP2C19 P33261 1/20 0.50

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
SCHEMBL11750711 0.82 ENPP2 (0.78) ENPP2SMN1; SMN2NPC1RAB9AHTT
SCHEMBL5582571 0.80 TGM2 (0.54) ENPP2
SCHEMBL14473182 0.77 ABL1 (0.46) SMN1; SMN2ABL1RIN1
SCHEMBL2476561 0.77 ENPP2 (0.70) ENPP2SMN1; SMN2NPC1RAB9AHTT
Hydrochloric Acid SCHEMBL5681091 0.76 ENPP2 (0.66) ENPP2SMN1; SMN2NPC1RAB9AHTT
SCHEMBL5347279 0.76 ENPP2 (0.68) ENPP2SMN1; SMN2NPC1RAB9AHTT
SCHEMBL12771582 0.76 ENPP2 (0.65) ENPP2SMN1; SMN2NPC1RAB9AHTT
SCHEMBL13388216 0.75 ENPP2 (0.67) ENPP2SMN1; SMN2NPC1RAB9AHTT
SCHEMBL15379737 0.75 ENPP2 (0.64) ENPP2SMN1; SMN2NPC1RAB9AHTT
SCHEMBL5582856 0.74 SIGMAR1 (0.52) SMN1; SMN2ABL1RIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US claimed
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-20070173498-A1 Melanin concentrating hormone antagonist KATO KANEYOSHI 2007-07-26 US disclosed
US-7115750-B1 Melanin concentrating hormone antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-10-03 US disclosed
EP-1218336-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP disclosed
WO-2001021577-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-29 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-20070173498-A1 Melanin concentrating hormone antagonist MC1R, MCHR1, MCHR2 ENPP2 3258/4885SMN1; SMN2 3652/4885NPC1 1085/4885

“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.