SCHEMBL7532686

SCHEMBL7532686

N#Cc1c[nH]c2cccc(N3CCN(CCc4c[nH]c5ccccc45)CC3)c12

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.59
ABCC1 P33527 6/20 0.56
HTR2A P28223 2/20 0.56
HTR7 P34969 1/20 0.54
ABCB1 P08183 3/20 0.54
ABCG2 Q9UNQ0 3/20 0.54
HTR1A P08908 2/20 0.53
HTR6 P50406 1/20 0.52
KCNH2 Q12809 1/20 0.52

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
SCHEMBL7538171 0.88 DRD2 (0.55) DRD2ABCC1HTR2AHTR7ABCB1
SCHEMBL7534426 0.86 DRD2 (0.56) DRD2ABCC1HTR2AHTR7HTR1A
SCHEMBL7532684 0.86 HTR1A (0.48) DRD2ABCC1HTR2AHTR7ABCB1
SCHEMBL7532422 0.83 HTR1A (0.65) DRD2HTR1A
SCHEMBL7532948 0.80 DRD2 (0.66) DRD2HTR2AHTR7HTR1A
SCHEMBL6465788 0.79 HTR2A (0.88) DRD2ABCC1HTR2AABCB1ABCG2
SCHEMBL7535732 0.79 HTR1A (0.51) DRD2HTR2AHTR7HTR1AHTR6
SCHEMBL7535737 0.79 HTR1A (0.46) DRD2HTR2AHTR7HTR1AHTR6
SCHEMBL7532828 0.78 DRD2 (0.51) DRD2ABCC1HTR2AHTR7ABCB1
SCHEMBL11105675 0.78 HTR2A (0.64) DRD2ABCC1HTR2AHTR7ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020128272-A1 4,5,6, and 7-indole and indoline derivatives, their preparation and use H. LUNDBECK A/S (DK) 2002-09-12 US claimed
US-6391882-B1 PSYCHOLOGICAL DISORDERS; ANTIDEPRESSANTS H. LUNDBECK A/S (DK) 2002-05-21 US claimed
EP-1089997-A1 4,5,6 AND 7-INDOLE AND INDOLINE DERIVATIVES, THEIR PREPARATION AND USE H.Lundbeck A/S (DK) 2001-04-11 EP claimed
WO-1999067237-A1 4,5,6 AND 7-INDOLE AND INDOLINE DERIVATIVES, THEIR PREPARATION AND USE H. LUNDBECK A/S (DK) 1999-12-29 WO claimed
US-20020128272-A1 4,5,6, and 7-indole and indoline derivatives, their preparation and use H. LUNDBECK A/S (DK) 2002-09-12 US disclosed
US-6391882-B1 PSYCHOLOGICAL DISORDERS; ANTIDEPRESSANTS H. LUNDBECK A/S (DK) 2002-05-21 US disclosed
CN-1336925-A 4,5,6 and 7-indole and indoline derivatives, their prepn. and use LUNDBECK & CO AS H (DK) 2002-02-20 CN disclosed
EP-1089997-A1 4,5,6 AND 7-INDOLE AND INDOLINE DERIVATIVES, THEIR PREPARATION AND USE H.Lundbeck A/S (DK) 2001-04-11 EP disclosed
WO-1999067237-A1 4,5,6 AND 7-INDOLE AND INDOLINE DERIVATIVES, THEIR PREPARATION AND USE H. LUNDBECK A/S (DK) 1999-12-29 WO 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-20020128272-A1 4,5,6, and 7-indole and indoline derivatives, their preparation and use HTR2C, HTR1A, HTR7 DRD2 49/4885ABCC1 2718/4885HTR2A 6/4885

“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.