SCHEMBL770437

SCHEMBL770437

O=C(CCCNC(=O)N1CCC2CCCCC2C1)N1CCN(c2ccccc2F)CC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.58
MEN1 O00255 4/20 0.58
MAPT P10636 3/20 0.58
LMNA P02545 2/20 0.58
TSHR P16473 1/20 0.58
NPC1 O15118 4/20 0.52
RAB9A P51151 4/20 0.52
CHRM4 P08173 1/20 0.48
ALDH1A1 P00352 5/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
POLB P06746 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CACNA1G O43497 1/20 0.45
GAA P10253 1/20 0.44
HTT P42858 1/20 0.43

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
SCHEMBL771321 0.89 KMT2A (0.67) KMT2AMEN1MAPTLMNATSHR
SCHEMBL772211 0.89 AR (0.53) KMT2AMEN1MAPTLMNATSHR
SCHEMBL770989 0.80 PRKAB2 (0.48) MAPTLMNACHRM4ALDH1A1POLB
SCHEMBL771875 0.79 ATM (0.44) KMT2AMEN1LMNANPC1L3MBTL1
SCHEMBL770761 0.79 ATM (0.44) KMT2AMEN1LMNANPC1L3MBTL1
SCHEMBL772269 0.79 ATM (0.44) KMT2AMEN1LMNANPC1L3MBTL1
SCHEMBL770674 0.78 KMT2A (0.55) KMT2AMEN1MAPTLMNATSHR
SCHEMBL771047 0.77 NPC1 (0.54) KMT2AMEN1MAPTLMNANPC1
SCHEMBL770432 0.77 AR (0.60) KMT2AMEN1MAPTLMNATSHR
SCHEMBL771346 0.77 AR (0.60) KMT2AMEN1MAPTLMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130303522-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2013-11-14 US disclosed
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2012-03-22 US disclosed
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2012-03-22 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-20130303522-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 KMT2A 3868/4885MEN1 827/4885MAPT 618/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 KMT2A 3893/4885MEN1 823/4885MAPT 638/4885

“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.