SCHEMBL4160984

SCHEMBL4160984

COc1ccc2c(c1)CCc1ccccc1C2=Cc1ccc(N)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 4/20 0.53
ABCB1 P08183 1/20 0.49
MAOB P27338 2/20 0.49
MAPT P10636 2/20 0.48
CYP26A1 O43174 2/20 0.48
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
PKM P14618 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 1/20 0.48
ATM Q13315 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CYP19A1 P11511 5/20 0.48
CYP11B2 P19099 4/20 0.48
BCHE P06276 1/20 0.47
ACHE P22303 1/20 0.47
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CYP11B1 P15538 2/20 0.44

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
SCHEMBL4160979 1.00 MIF (0.53) MIFABCB1MAOBMAPTCYP26A1
SCHEMBL4157857 0.88 MAPT (0.55) MIFABCB1MAOBMAPTMEN1
SCHEMBL4163634 0.87 MIF (0.64) MIFABCB1MAOBMAPTCYP26A1
SCHEMBL4163632 0.87 MIF (0.64) MIFABCB1MAOBMAPTCYP26A1
SCHEMBL4157130 0.85 SMPD1 (0.51) MIFMAOBMAPTMEN1NPC1
SCHEMBL4163879 0.83 HTR6 (0.46) MIFMAOBMAPTNPC1PKM
SCHEMBL13814234 0.81 MIF (0.44) MIFABCB1MAOBMAPTCYP26A1
SCHEMBL13802248 0.81 NR3C1 (0.63) MIFABCB1MAOBMAPTCYP26A1
SCHEMBL4150992 0.81 MIF (0.56) MIFABCB1MAOBMAPTCYP26A1
SCHEMBL4150994 0.81 MIF (0.56) MIFABCB1MAOBMAPTCYP26A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS COGHLAN MICHAEL JOSEPH 2009-06-11 US disclosed
US-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS COGHLAN MICHAEL JOSEPH 2009-06-11 US disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-20060063759-A1 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY 2006-03-23 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-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS NR5A1, NR3C2, NR3C1 MIF 1642/4885ABCB1 523/4885MAOB 2154/4885
US-20060063759-A1 Tricyclic steroid hormone nuclear receptor modulators NR5A1, NR3C2, NR3C1 MIF 1592/4885ABCB1 527/4885MAOB 2012/4885

“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.