SCHEMBL5583031

SCHEMBL5583031

O=C(Nc1ccc2c(c1)NCC(CN1CCCC1)O2)c1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 9/20 0.50
HTR2C P28335 2/20 0.50
MLLT1 Q03111 1/20 0.47
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
POLB P06746 1/20 0.42
CYP3A4 P08684 1/20 0.42
GAA P10253 1/20 0.42
CYP2D6 P10635 1/20 0.42
THRB P10828 1/20 0.42
CYP2C19 P33261 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SLC2A1 P11166 1/20 0.42
CYSLTR1 Q9Y271 1/20 0.42
EPHX2 P34913 1/20 0.42
ACKR3 P25106 1/20 0.42

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
SCHEMBL5582926 0.91 HTR2C (0.52) MCHR1HTR2CMAPTNPC1RAB9A
SCHEMBL5582936 0.83 MCHR1 (0.53) MCHR1NPC1RAB9ASLC2A1CYSLTR1
SCHEMBL5582679 0.81 MCHR1 (0.57) MCHR1HTR2C
SCHEMBL5583043 0.78 RORC (0.49) MCHR1HTR2CALDH1A1KDM4EMAPT
SCHEMBL5582877 0.74 MCHR1 (0.59) MCHR1HTR2CMAPTHPGDNPC1
SCHEMBL5582534 0.71 MCHR1 (0.54) MCHR1HTR2CMAPTNPC1RAB9A
SCHEMBL5582632 0.70 MCHR1 (0.69) MCHR1SLC2A1
SCHEMBL5582713 0.70 MCHR1 (0.68) MCHR1ALDH1A1KDM4EMAPTHPGD
SCHEMBL5775241 0.70 POLB (0.47) MCHR1NPC1RAB9APOLBSMN1; SMN2
SCHEMBL5582863 0.69 MCHR1 (0.44) MCHR1ALDH1A1

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 195/4885MLLT1 3746/4885

“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.