SCHEMBL5582730

SCHEMBL5582730

CC1=C(CN2CCCC2)CCc2cc(NC(=O)c3ccc(-c4ccc(Cl)cc4)cc3)ccc21

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 12/20 0.64
HTR2C P28335 3/20 0.55
BID P55957 2/20 0.52
BCL2A1 Q16548 2/20 0.52
ALDH1A1 P00352 2/20 0.52
POLB P06746 1/20 0.51
CYP3A4 P08684 1/20 0.51
GAA P10253 1/20 0.51
CYP2D6 P10635 1/20 0.51
THRB P10828 1/20 0.51
CYP2C19 P33261 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MLLT1 Q03111 1/20 0.49
SLC2A1 P11166 2/20 0.49
KDM4E B2RXH2 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL5582598 0.93 MCHR1 (0.66) MCHR1HTR2CBIDBCL2A1SLC2A1
SCHEMBL5582969 0.91 MCHR1 (0.63) MCHR1HTR2C
SCHEMBL5582714 0.90 MCHR1 (0.64) MCHR1HTR2CALDH1A1SMN1; SMN2KDM4E
SCHEMBL5583099 0.89 MCHR1 (0.67) MCHR1HTR2CALDH1A1THRBKDM4E
SCHEMBL5582728 0.86 MCHR1 (0.61) MCHR1HTR2CBIDBCL2A1ALDH1A1
SCHEMBL5582939 0.85 MCHR1 (0.57) MCHR1HTR2CALDH1A1SMN1; SMN2MAPT
SCHEMBL5582779 0.84 MCHR1 (0.56) MCHR1HTR2CBIDBCL2A1
SCHEMBL5582523 0.83 MCHR1 (0.55) MCHR1HTR2CSMN1; SMN2
SCHEMBL5583052 0.83 MCHR1 (0.56) MCHR1HTR2CBIDBCL2A1SLC2A1
SCHEMBL5582587 0.83 MCHR1 (0.65) MCHR1SLC2A1

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-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 195/4885BID 3215/4885

“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.