SCHEMBL5582662

SCHEMBL5582662

CC1=C(CN2CCN(C)CC2)CCc2cc(N)ccc21

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
NR1H2 P55055 1/20 0.46
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HSD17B10 Q99714 1/20 0.41
S1PR1 P21453 12/20 0.38
S1PR3 Q99500 6/20 0.38
MC4R P32245 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
RAD52 P43351 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
SCHEMBL5582836 0.90 ACHE (0.43) CASP1CASP7HSD17B10S1PR1S1PR3
SCHEMBL5582751 0.75 CASP1 (0.46) LMNACASP1CASP7HSD17B10KDM4E
SCHEMBL10670021 0.71 KDM4E (0.42) S1PR1S1PR3KDM4E
SCHEMBL5582939 0.71 MCHR1 (0.57) MAPT
SCHEMBL5582887 0.70 MCHR1 (0.51) LMNANR1H2MC4RKDM4EMAPT
SCHEMBL5582743 0.70 ACHE (0.40) LMNACASP1CASP7HSD17B10MAPT
SCHEMBL4758225 0.70 NR1H2 (0.64) LMNANR1H2MC4RKDM4EMAPT
SCHEMBL3396724 0.70 NR1H2 (0.60) LMNANR1H2MC4RKDM4EMAPT
SCHEMBL6273608 0.68 NR1H2 (0.61) LMNANR1H2MC4RKDM4EMAPT
Hydrochloric Acid SCHEMBL6268461 0.67 NR1H2 (0.60) LMNANR1H2MC4RKDM4EMAPT

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 LMNA 4047/4885NR1H2 325/4885CASP1 3798/4885

“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.