SCHEMBL435756

SCHEMBL435756

CC(c1ccc(Cl)cc1)C1CC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 11/20 0.53
SLC6A2 P23975 10/20 0.53
SLC6A3 Q01959 10/20 0.53
ADRB2 P07550 1/20 0.48
FPR2 P25090 1/20 0.46
PROKR1 Q8TCW9 1/20 0.46
HPGD P15428 2/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CHRM1 P11229 1/20 0.40
DRD3 P35462 1/20 0.40
TSHR P16473 2/20 0.39
MAPK1 P28482 2/20 0.39
HIF1A Q16665 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL12261486 0.91 SLC6A4 (0.59) SLC6A4SLC6A2SLC6A3ADRB2FPR2
SCHEMBL19194749 0.90 SLC6A2 (0.57) SLC6A4SLC6A2SLC6A3ADRB2FPR2
SCHEMBL17086550 0.86 BCL2A1 (0.49) SLC6A4SLC6A2SLC6A3ADRB2FPR2
SCHEMBL21254366 0.86 BCL2A1 (0.49) SLC6A4SLC6A2SLC6A3ADRB2FPR2
SCHEMBL12120376 0.83 FPR2 (0.48) SLC6A4SLC6A2SLC6A3ADRB2FPR2
SCHEMBL11231139 0.81 ADRB2 (0.46) SLC6A4SLC6A2SLC6A3ADRB2HPGD
SCHEMBL8380860 0.80 FPR2 (0.41) SLC6A4SLC6A2SLC6A3ADRB2FPR2
SCHEMBL19200332 0.77 SLC6A2 (0.41) SLC6A4SLC6A2SLC6A3CHRM1DRD3
SCHEMBL17602352 0.77 POLB (0.42) SLC6A4SLC6A2SLC6A3TSHR
SCHEMBL23555214 0.77 SLC6A2 (0.38) SLC6A4SLC6A2SLC6A3FPR2PROKR1

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-9206173-B2 Heterocyclic compounds for the treatment of stress-related conditions OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-12-08 US disclosed
US-9206173-B2 Heterocyclic compounds for the treatment of stress-related conditions OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-12-08 US disclosed
US-20120065189-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF STRESS-RELATED CONDITIONS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-03-15 US disclosed
US-20120065189-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF STRESS-RELATED CONDITIONS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-03-15 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 (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-20120065189-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF STRESS-RELATED CONDITIONS NR3C1, NR3C2, CRH SLC6A4 469/4885SLC6A2 281/4885SLC6A3 603/4885

“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.