SCHEMBL3780137

SCHEMBL3780137

CCC1Cc2cc3nc(N)sc3cc2C1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 15/20 0.68
DRD4 P21917 1/20 0.64
DRD3 P35462 1/20 0.64
KCNH2 Q12809 4/20 0.57
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 2/20 0.49
TP53 P04637 2/20 0.49
CYP3A4 P08684 2/20 0.49
TSHR P16473 2/20 0.49
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
OPRM1 P35372 2/20 0.44
OPRD1 P41143 2/20 0.44
OPRK1 P41145 2/20 0.44
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL8006961 0.81 DRD2 (1.00) DRD2DRD4DRD3KCNH2SMN1; SMN2
SCHEMBL8008834 0.81 DRD2 (0.80) DRD2DRD4DRD3KCNH2SMN1; SMN2
SCHEMBL8006320 0.81 DRD2 (1.00) DRD2DRD4DRD3KCNH2SMN1; SMN2
SCHEMBL13729374 0.81 DRD2 (1.00) DRD2DRD4DRD3KCNH2SMN1; SMN2
SCHEMBL7393183 0.80 DRD2 (0.61) DRD2DRD4DRD3KCNH2SMN1; SMN2
SCHEMBL7996935 0.80 DRD2 (0.61) DRD2DRD4DRD3KCNH2SMN1; SMN2
Bromide SCHEMBL3786484 0.80 DRD2 (0.97) DRD2DRD4DRD3KCNH2SMN1; SMN2
SCHEMBL13730744 0.79 DRD2 (1.00) DRD2DRD4DRD3KCNH2SMN1; SMN2
SCHEMBL13729821 0.78 DRD2 (0.72) DRD2DRD4DRD3KCNH2SMN1; SMN2
SCHEMBL3787122 0.76 DRD2 (0.53) DRD2DRD4DRD3KCNH2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2254876-A1 COMPOUND (R) -N*6*-ETHYL-6, 7-DIHYDRO-5H-INDENO (5, 6- D) THIAZOLE-2, 6-DIAMINE AND THE USE AS ANTIPSYCHOTICS AstraZeneca AB (SE) 2010-12-01 EP disclosed
WO-2009105026-A1 COMPOUND (R) -N*6*-ETHYL-6, 7-DIHYDRO-5H-INDENO (5, 6- D) THIAZOLE-2, 6-DIAMINE AND THE USE AS ANTIPSYCHOTICS ASTRAZENECA AB (SE) 2009-08-27 WO disclosed
US-20090215841-A1 D2 Receptor Ligand-078 ASTRAZENECA AB (SE) 2009-08-27 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-20090215841-A1 D2 Receptor Ligand-078 TACR2, TACR1, GPR174 DRD2 39/4885DRD4 186/4885DRD3 119/4885

“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.