SCHEMBL770999

SCHEMBL770999

COc1ccccc1N1CCN(C(=O)C(=O)N2CCCC3CCCC=C32)CC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.51
TACR3 P29371 1/20 0.48
RAB9A P51151 1/20 0.48
AKR1C3 P42330 1/20 0.47
ALDH1A1 P00352 4/20 0.47
TSHR P16473 2/20 0.47
KDM4E B2RXH2 2/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
EED O75530 1/20 0.46
DRD2 P14416 1/20 0.46
DRD3 P35462 1/20 0.46
POLB P06746 1/20 0.46
HPGDS O60760 1/20 0.46

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
SCHEMBL769469 0.87 RAB9A (0.52) PKMRAB9AALDH1A1TSHRKDM4E
SCHEMBL770749 0.87 L3MBTL1 (0.56) RAB9AALDH1A1TSHRKDM4EKMT2A
SCHEMBL769754 0.86 TSHR (0.51) AKR1C3ALDH1A1TSHRKMT2AMEN1
SCHEMBL770284 0.85 L3MBTL1 (0.52) RAB9AALDH1A1TSHRKDM4EKMT2A
SCHEMBL770717 0.82 PKM (0.52) PKMTACR3RAB9AAKR1C3ALDH1A1
SCHEMBL16026545 0.79 PKM (0.74) PKMRAB9AAKR1C3ALDH1A1TSHR
SCHEMBL770273 0.77 HTT (0.35) ALDH1A1KDM4ETDP1POLB
SCHEMBL770676 0.76 L3MBTL1 (0.48) PKMRAB9AALDH1A1TSHRKDM4E
SCHEMBL770537 0.75 ALDH1A1 (0.33) ALDH1A1KMT2AMEN1POLB
SCHEMBL770764 0.75 SMN1; SMN2 (0.33) ALDH1A1

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-8822452-B2 Inhibitor compounds of 11-beta-hydroxysteroid dehydrogenase type 1 LABORATORIOS SALVAT, S.A. (ES) 2014-09-02 US disclosed
US-20130303522-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 LABORATORIOS SALVAT, S.A. (ES) 2013-11-14 US disclosed
US-8524894-B2 Inhibitor compounds of 11-beta-hydroxysteroid dehydrogenase type 1 LABORATORIOS SALVAT, S.A. (ES) 2013-09-03 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 PKM 1551/4885TACR3 4428/4885RAB9A 2187/4885
US-20120071466-A1 INHIBITOR COMPOUNDS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD11B2 PKM 1554/4885TACR3 4442/4885RAB9A 2217/4885

“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.