SCHEMBL5582939

SCHEMBL5582939

CC1=C(CN2CCN(C)CC2)CCc2cc(NC(=O)c3ccc(-c4ccc(C)cc4)cc3)ccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 8/20 0.57
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
LCK P06239 4/20 0.49
CSF1R P07333 4/20 0.49
MAPK14 Q16539 2/20 0.49
HTR2C P28335 2/20 0.48
BTK Q06187 1/20 0.48
MAPT P10636 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 1/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
EGFR P00533 1/20 0.48
KDR P35968 1/20 0.48
ERBB4 Q15303 1/20 0.48
TP53 P04637 1/20 0.47
ABL1 P00519 1/20 0.47
CHRM2 P08172 1/20 0.45

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 0.92 MCHR1 (0.66) MCHR1LCKCSF1RMAPK14HTR2C
SCHEMBL5582523 0.92 MCHR1 (0.55) MCHR1NPC1RAB9ALCKCSF1R
SCHEMBL5582590 0.91 MCHR1 (0.58) MCHR1NPC1RAB9AMAPK14MAPT
SCHEMBL5582969 0.86 MCHR1 (0.63) MCHR1HTR2C
SCHEMBL5582730 0.85 MCHR1 (0.64) MCHR1HTR2CMAPTSMN1; SMN2ALDH1A1
SCHEMBL5582714 0.85 MCHR1 (0.64) MCHR1NPC1RAB9AMAPK14HTR2C
SCHEMBL5582951 0.84 MCHR1 (0.63) MCHR1NPC1RAB9AHTR2CMAPT
SCHEMBL5583099 0.83 MCHR1 (0.67) MCHR1RAB9AMAPK14HTR2CMAPT
SCHEMBL5582779 0.83 MCHR1 (0.56) MCHR1RAB9ALCKCSF1RMAPK14
SCHEMBL5583052 0.82 MCHR1 (0.56) MCHR1LCKCSF1RMAPK14HTR2C

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 2/4885NPC1 1085/4885RAB9A 1813/4885

“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.