SCHEMBL7121257

SCHEMBL7121257

CC(=O)SCC1(NC2CCCC2)CCCC1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.33
EPHX2 P34913 5/20 0.33
MAPT P10636 2/20 0.33
HTT P42858 1/20 0.32
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
SMN1; SMN2 Q16637 3/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
CYP3A4 P08684 1/20 0.31
THRB P10828 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL7115478 0.70 ALDH1A1 (0.38) HTTALDH1A1SMN1; SMN2CYP3A4
SCHEMBL7117796 0.70 DPP4 (0.36) EPHX1EPHX2MAPTKDM4EALDH1A1
SCHEMBL11037957 0.69 ALDH1A1 (0.35) EPHX1MAPTKDM4EALDH1A1L3MBTL1
SCHEMBL7118706 0.69 DPP4 (0.37) EPHX1EPHX2MAPTKDM4EALDH1A1
SCHEMBL7115479 0.68 HDAC3 (0.33) EPHX1EPHX2MAPTKDM4EALDH1A1
SCHEMBL15426304 0.67 P2RX7 (0.39) EPHX1
SCHEMBL7118469 0.66 DPP4 (0.36)
SCHEMBL7114870 0.66 ALDH1A1 (0.31) ALDH1A1
SCHEMBL7156838 0.66 ALDH1A1 (0.31) ALDH1A1
SCHEMBL7435851 0.65 CYP2C19 (0.31) ATM

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-20030207865-A1 Substituted 2-arylimino heterocycles and compositions containing them for use as progesterone receptor binding agents DIXON BRIAN R (US) 2003-11-06 US disclosed
US-6353006-B1 TREATMENT OF BONE DISORDERS, OSTEOPOROSIS AND HEALING AGENT BAYER CORPORATION 2002-03-05 US disclosed
EP-1144396-A2 SUBSTITUTED 2-ARYLIMINO HETEROCYCLES AND COMPOSITIONS CONTAINING THEM, FOR USE AS PROGESTERONE RECEPTOR BINDING AGENTS Bayer Corporation (US) 2001-10-17 EP disclosed
WO-2000042031-A2 SUBSTITUTED 2-ARYLIMINO HETEROCYCLES AND COMPOSITIONS CONTAINING THEM, FOR USE AS PROGESTERONE RECEPTOR BINDING AGENTS BAYER CORPORATION (US) 2000-07-20 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-20030207865-A1 Substituted 2-arylimino heterocycles and compositions containing them for use as progesterone receptor binding agents PGR, PGRMC2, PGRMC1 EPHX1 2181/4885EPHX2 2575/4885MAPT 4372/4885

“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.