SCHEMBL4159260

SCHEMBL4159260

COCC=C1c2ccccc2CCc2cc(Cl)ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 3/20 0.47
CYP3A4 P08684 5/20 0.46
LMNA P02545 5/20 0.46
SLC6A2 P23975 4/20 0.46
CYP1A2 P05177 4/20 0.46
RET P07949 3/20 0.46
CYP2D6 P10635 3/20 0.46
MTOR P42345 3/20 0.46
TP53 P04637 3/20 0.46
CYP2C19 P33261 3/20 0.46
ADRB2 P07550 2/20 0.46
CHRM2 P08172 2/20 0.46
CHRM4 P08173 2/20 0.46
ADRB1 P08588 2/20 0.46
HTR1A P08908 2/20 0.46
CHRM5 P08912 2/20 0.46
ADRA2A P08913 2/20 0.46
CHRM1 P11229 2/20 0.46
DRD2 P14416 2/20 0.46
ADRA2B P18089 2/20 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
SCHEMBL4159257 1.00 HTR2B (0.47) HTR2BCYP3A4LMNASLC6A2CYP1A2
SCHEMBL4153583 0.82 HTR2B (0.46) HTR2BCYP3A4LMNASLC6A2CYP1A2
SCHEMBL4153580 0.82 HTR2B (0.46) HTR2BCYP3A4LMNASLC6A2CYP1A2
SCHEMBL22147102 0.80 MAOB (0.44) HTR2BCYP3A4LMNASLC6A2CYP1A2
SCHEMBL21859244 0.80 HTR2B (0.76) HTR2BCYP3A4LMNASLC6A2CYP1A2
SCHEMBL22073557 0.80 HTR2B (0.76) HTR2BCYP3A4LMNASLC6A2CYP1A2
SCHEMBL21859242 0.80 LMNA (0.76) HTR2BCYP3A4LMNASLC6A2CYP1A2
SCHEMBL4068688 0.78 SRD5A1 (0.55) HTR2BLMNASLC6A2ADRB2CHRM2
SCHEMBL4036590 0.77 HTT (0.44) HTR2BCYP3A4LMNASLC6A2CYP1A2
SCHEMBL4161951 0.77 HTT (0.44) HTR2BCYP3A4LMNASLC6A2CYP1A2

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 HTR2B 962/4885CYP3A4 385/4885LMNA 2774/4885
US-20060063759-A1 Tricyclic steroid hormone nuclear receptor modulators NR5A1, NR3C2, NR3C1 HTR2B 891/4885CYP3A4 381/4885LMNA 2846/4885

“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.