SCHEMBL6424121

SCHEMBL6424121

CN1CCN(CCc2c(Br)ccc3c2cc2n3Cc3ccccc3-2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 8/20 0.38
▸ MTNR1A P48039 10/20 0.37
▸ MTNR1B P49286 10/20 0.37
▸ CYP3A4 P08684 2/20 0.34
▸ CYP2D6 P10635 2/20 0.34
▸ CYP2C19 P33261 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ APEX1 P27695 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL6425851 0.82 MTNR1A (0.38) HTR6MTNR1AMTNR1BCYP3A4CYP2D6
SCHEMBL6421586 0.80 MTNR1A (0.37) MTNR1AMTNR1BCYP3A4CYP2D6CYP2C19
SCHEMBL3248612 0.80 MTNR1A (0.48) HTR6MTNR1AMTNR1BCYP3A4CYP2D6
Dimethylamine SCHEMBL6425854 0.79 MTNR1A (0.39) MTNR1AMTNR1BCYP3A4CYP2D6CYP2C19
SCHEMBL6437518 0.78 MTNR1A (0.36) MTNR1AMTNR1BCYP3A4CYP2D6CYP2C19
Diethylamine SCHEMBL6421589 0.77 MTNR1A (0.38) MTNR1AMTNR1BCYP3A4CYP2D6CYP2C19
SCHEMBL3248497 0.74 MTNR1A (0.59) MTNR1AMTNR1B
SCHEMBL3245162 0.72 MTNR1A (0.46) MTNR1AMTNR1BCYP3A4CYP2D6CYP2C19
SCHEMBL5095550 0.66 HTR6 (0.46) HTR6KDM4EALDH1A1MAPTHTR2A
SCHEMBL3244758 0.65 MTNR1A (0.57) MTNR1AMTNR1BHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050203103-A1 Arylalkyl indoles having serotonin receptor affinity useful as therapeutic agents, process for their preparation and pharmaceutical compositions containing them SUVEN LIFE SCIENCES LIMITED (IN) 2005-09-15 — — 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-20050203103-A1 Arylalkyl indoles having serotonin receptor affinity useful as therapeutic agents, process for their preparation and pharmaceutical compositions containing them TPH1, HTR1A, HTR7 HTR6 9/4885MTNR1A 76/4885MTNR1B 105/4885

“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.

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