SCHEMBL7523988

SCHEMBL7523988

CCn1c(NCCN2CCN(c3ccccc3)CC2)nc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.52
LMNA P02545 4/20 0.52
HTT P42858 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
MAPT P10636 2/20 0.52
TRPC5 Q9UL62 2/20 0.50
SLC2A1 P11166 2/20 0.49
ALDH1A1 P00352 2/20 0.49
DRD2 P14416 1/20 0.48
SIGMAR1 Q99720 1/20 0.48
KDM4E B2RXH2 2/20 0.47
TP53 P04637 1/20 0.47
GAA P10253 1/20 0.47
MAPK1 P28482 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
HTR1A P08908 1/20 0.47
HTR2A P28223 1/20 0.47
CHRNA7 P36544 1/20 0.47
KDM1A O60341 1/20 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
Bromide SCHEMBL7528105 0.99 LMNA (0.51) GRM2LMNAHTTSMN1; SMN2MAPT
SCHEMBL7516307 0.84 ALDH1A1 (0.57) GRM2HTTSMN1; SMN2ALDH1A1DRD2
SCHEMBL7528484 0.84 ALDH1A1 (0.58) GRM2LMNASMN1; SMN2MAPTSLC2A1
Bromide SCHEMBL7520978 0.84 ALDH1A1 (0.56) GRM2HTTSMN1; SMN2ALDH1A1DRD2
SCHEMBL7527192 0.83 HTR1A (0.62) LMNASMN1; SMN2DRD2KDM4EHTR1A
Bromide SCHEMBL7519489 0.83 ALDH1A1 (0.57) GRM2LMNASMN1; SMN2MAPTSLC2A1
Bromide SCHEMBL7526692 0.82 HTR1A (0.61) LMNASMN1; SMN2DRD2KDM4EHTR1A
SCHEMBL8233241 0.77 LMNA (0.82) GRM2LMNAHTTSMN1; SMN2MAPT
SCHEMBL7519980 0.74 PHGDH (0.65) GRM2SMN1; SMN2MAPTALDH1A1DRD2
Bromide SCHEMBL7525103 0.73 PHGDH (0.64) GRM2SMN1; SMN2MAPTALDH1A1DRD2

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-20020058666-A1 2-piperazinoalkylaminobenzoazole derivatives: dopamine receptor subtype specific ligands NEUROGEN CORPORATION 2002-05-16 US claimed
US-6284759-B1 PSYCHOLOGICAL DISORDERS; NERVOUS SYSTEM DISORDERS NEUROGEN CORPORATION 2001-09-04 US claimed
US-6432958-B1 FOR THERAPY AND PROPHYLAXIS OF NEUROPSYCHOLOGICAL DISORDERS SUCH AS SCHIZOPHRENIA, MANIA, DEMENTIA, DEPRESSION, ANXIETY, COMPULSIVE BEHAVIOR, SUBSTANCE ABUSE, MOTOR DISORDERS AND MOTION DISORDERS RELATED TO USE OF NEUROLEPTIC AGENT NEUROGEN CORPORATION 2002-08-13 US disclosed
US-20020058666-A1 2-piperazinoalkylaminobenzoazole derivatives: dopamine receptor subtype specific ligands NEUROGEN CORPORATION 2002-05-16 US disclosed
US-6284759-B1 PSYCHOLOGICAL DISORDERS; NERVOUS SYSTEM DISORDERS NEUROGEN CORPORATION 2001-09-04 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-20020058666-A1 2-piperazinoalkylaminobenzoazole derivatives: dopamine receptor subtype specific ligands CHRNA7, HTR7, OPRD1 GRM2 84/4885LMNA 4356/4885HTT 308/4885

“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.