SCHEMBL239977

SCHEMBL239977

CCCNC(=O)N1CCC(Oc2ccc(C(=O)N3CC4CCC(CC4)C3)cc2)C1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.48
CYP2C19 P33261 1/20 0.46
LMNA P02545 4/20 0.45
ADRB2 P07550 2/20 0.44
MEN1 O00255 2/20 0.44
CHRNA7 P36544 1/20 0.44
POLB P06746 2/20 0.44
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HRH3 Q9Y5N1 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 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
SCHEMBL239976 0.83 HRH3 (0.48) KMT2AMEN1POLBALDH1A1HRH3
SCHEMBL13047991 0.82 HRH3 (0.48) KMT2ALMNAMEN1ALDH1A1HRH3
SCHEMBL4449045 0.81 KMT2A (0.50) KMT2ALMNAADRB2MEN1POLB
SCHEMBL240984 0.80 KMT2A (0.51) KMT2ALMNAADRB2MEN1POLB
SCHEMBL240916 0.77 HRH1 (0.58) KMT2ALMNACHRNA7POLB
SCHEMBL237311 0.75 KMT2A (0.58) KMT2AMEN1POLBHRH3
SCHEMBL240460 0.75 LMNA (0.59) KMT2ALMNAPOLBALDH1A1SMN1; SMN2
SCHEMBL12516082 0.74 POLB (0.62) KMT2ALMNAPOLBALDH1A1HPGD
SCHEMBL6586306 0.73 EPHX2 (0.49) CHRNA7POLB
SCHEMBL240534 0.73 PRKAA2 (0.49) KMT2APOLBALDH1A1HPGD

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-20100292215-A1 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS HIGH POINT PHARMACEUTICALS, LLC (US) 2010-11-18 US claimed
US-20120004209-A1 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Active Compounds HIGH POINT PHARMACEUTICALS, LLC (US) 2012-01-05 US disclosed
US-8053447-B2 11β-hydroxysteroid dehydrogenase type 1 active compounds HIGH POINT PHARMACEUTICALS, LLC (US) 2011-11-08 US disclosed
US-20100292215-A1 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS HIGH POINT PHARMACEUTICALS, LLC (US) 2010-11-18 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 (2 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-20120004209-A1 11-Beta-Hydroxysteroid Dehydrogenase Type 1 Active Compounds HSD11B1, HSD3B1, HSD11B2 KMT2A 3823/4885CYP2C19 279/4885LMNA 2424/4885
US-20100292215-A1 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 ACTIVE COMPOUNDS HSD11B1, HSD3B1, HSD17B1 KMT2A 3848/4885CYP2C19 194/4885LMNA 2575/4885

“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.