SCHEMBL737481

SCHEMBL737481

O=C(c1ccc(-n2ccnc2)cc1)N1CCC2(C=Cc3ccccc32)CC1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCHR2 Q969V1 1/20 0.50
LSS P48449 1/20 0.48
KMT2A Q03164 1/20 0.47
NPC1L1 Q9UHC9 1/20 0.46
HSD11B1 P28845 1/20 0.46
FFAR1 O14842 1/20 0.44
CYP3A4 P08684 1/20 0.43
BAZ2B Q9UIF8 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
ADH5 P11766 1/20 0.42
NAMPT P43490 1/20 0.42
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL3104338 0.78 LSS (0.52) LSSKMT2ACYP3A4BAZ2BHTR2A
SCHEMBL762618 0.76 MCHR2 (0.58) MCHR2NPC1L1HSD11B1FFAR1NR1H2
SCHEMBL4984631 0.76 MCHR2 (0.60) MCHR2KMT2ANPC1L1HSD11B1FFAR1
SCHEMBL739407 0.75 MCHR2 (0.50) MCHR2KMT2ANPC1L1HSD11B1FFAR1
SCHEMBL3839355 0.74 MCHR2 (0.61) MCHR2NPC1L1HSD11B1FFAR1HTT
SCHEMBL3837633 0.73 MCHR2 (0.60) MCHR2KMT2ANPC1L1HSD11B1
SCHEMBL395086 0.73 HSD11B1 (0.64) MCHR2NPC1L1HSD11B1NR1H2NR1H3
SCHEMBL9363641 0.72 HPGD (0.68) LSSKMT2ACYP3A4BAZ2BHTR2A
SCHEMBL8536306 0.72 LSS (0.60) LSSCYP3A4BAZ2BHTR2AHTR2C
Hydrochloric Acid SCHEMBL9368954 0.71 HPGD (0.66) LSSKMT2ACYP3A4BAZ2BHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105289-A1 11beta-hydroxysteroid dehydrogenase type 1 active spiro compounds NOVO NORDISK A/S (DK) 2009-04-23 US claimed
EP-1802623-A1 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE SPIRO COMPOUNDS Novo Nordisk A/S (DK) 2007-07-04 EP claimed
WO-2006040329-A1 1 IBETA- HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE SPIRO COMPOUNDS NOVO NORDISK A/S (DK) 2006-04-20 WO claimed
US-8138342-B2 11β-hydroxysteroid dehydrogenase type 1 active spiro compounds High Point Pharmacueticals, LLC (US) 2012-03-20 US disclosed
US-8138342-B2 11β-hydroxysteroid dehydrogenase type 1 active spiro compounds High Point Pharmacueticals, LLC (US) 2012-03-20 US disclosed
US-8138342-B2 11β-hydroxysteroid dehydrogenase type 1 active spiro compounds High Point Pharmacueticals, LLC (US) 2012-03-20 US disclosed
US-20090105289-A1 11beta-hydroxysteroid dehydrogenase type 1 active spiro compounds NOVO NORDISK A/S (DK) 2009-04-23 US disclosed
US-20090105289-A1 11beta-hydroxysteroid dehydrogenase type 1 active spiro compounds NOVO NORDISK A/S (DK) 2009-04-23 US disclosed
US-20090105289-A1 11beta-hydroxysteroid dehydrogenase type 1 active spiro compounds NOVO NORDISK A/S (DK) 2009-04-23 US disclosed
EP-1802623-A1 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE SPIRO COMPOUNDS Novo Nordisk A/S (DK) 2007-07-04 EP disclosed
WO-2006040329-A1 1 IBETA- HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE SPIRO COMPOUNDS NOVO NORDISK A/S (DK) 2006-04-20 WO 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-20090105289-A1 11beta-hydroxysteroid dehydrogenase type 1 active spiro compounds HSD11B1, HSD3B1, HSD17B1 MCHR2 3967/4885LSS 90/4885KMT2A 4099/4885

“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.