SCHEMBL5582623

SCHEMBL5582623

CN(C)CC1=Cc2ccc(N)cc2OC1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 17/20 0.40
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALOX12 P18054 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36

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
SCHEMBL5382944 0.75 MCHR1 (0.50) NPC1LMNARAB9ASMN1; SMN2KDM4E
SCHEMBL5582920 0.72 MCHR1 (0.34) NPC1LMNARAB9ASMN1; SMN2KDM4E
SCHEMBL5582583 0.71 MCHR1 (0.46)
SCHEMBL5582506 0.69 MCHR1 (0.39)
SCHEMBL30065911 0.68 MAPT (0.35) NPC1LMNARAB9ASMN1; SMN2KDM4E
SCHEMBL5582744 0.68 MCHR1 (0.41) KDM4EMEN1MAPTKMT2A
SCHEMBL5519316 0.66 ALOX5 (0.49) ALOX5NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL14501781 0.63 MCHR1 (0.47) KDM4EMEN1ALDH1A1MAPTKMT2A
SCHEMBL30081443 0.63 CA12 (0.44) ALOX5NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL9810014 0.61 HTR2C (0.41) ALOX5ALOX12MAPTPTGS1PTGS2

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 disclosed
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 ALOX5 4155/4885NPC1 1085/4885LMNA 4047/4885

“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.