SCHEMBL5582560

SCHEMBL5582560

O=C(Nc1ccc2c(c1)CCC(CN1CCCCC1)=C2)c1ccc(-c2ccc(F)cc2)cc1

nearest known ligand 0.98

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 18/20 0.98
HTR2C P28335 5/20 0.98
SMN1; SMN2 Q16637 2/20 0.52
NPC1 O15118 1/20 0.51
TP53 P04637 1/20 0.51
NFKB1 P19838 1/20 0.51
RAB9A P51151 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51

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
SCHEMBL5582658 0.99 MCHR1 (1.00) MCHR1HTR2CSMN1; SMN2NPC1TP53
SCHEMBL5582498 0.91 MCHR1 (0.98) MCHR1HTR2C
SCHEMBL5582708 0.90 MCHR1 (1.00) MCHR1HTR2C
SCHEMBL5582798 0.90 MCHR1 (1.00) MCHR1HTR2C
SCHEMBL5582922 0.90 MCHR1 (0.82) MCHR1HTR2CSMN1; SMN2NPC1TP53
SCHEMBL5582944 0.89 MCHR1 (0.81) MCHR1HTR2C
SCHEMBL5582835 0.89 MCHR1 (0.82) MCHR1HTR2CSMN1; SMN2NPC1TP53
SCHEMBL5582935 0.89 MCHR1 (1.00) MCHR1HTR2C
SCHEMBL5582522 0.89 MCHR1 (1.00) MCHR1HTR2CSMN1; SMN2NPC1NFKB1
Hydrochloric Acid SCHEMBL5583046 0.88 MCHR1 (0.80) MCHR1HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7115750-B1 Melanin concentrating hormone antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-10-03 US claimed
EP-1218336-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP claimed
WO-2001021577-A2 MELANIN CONCENTRATING HORMONE ANTAGONIST TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-29 WO 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-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

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 MCHR1 2/4885HTR2C 195/4885SMN1; SMN2 3652/4885

“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.