SCHEMBL16807895

SCHEMBL16807895

CCCCCCCN1CCc2cc(Cl)c(C)cc2C(c2ccccc2)C1

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DRD1 P21728 4/20 0.51
▸ DRD5 P21918 2/20 0.51
▸ CYP1A2 P05177 2/20 0.51
▸ CYP2D6 P10635 2/20 0.51
▸ DRD2 P14416 2/20 0.51
▸ TSHR P16473 2/20 0.51
▸ HSD17B10 Q99714 2/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ NFKB1 P19838 1/20 0.51
▸ THPO P40225 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ ALOX15 P16050 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ SIGMAR1 Q99720 1/20 0.51
▸ LMNA P02545 1/20 0.50

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
SCHEMBL16807896 0.99 DRD1 (0.52) DRD1DRD5CYP1A2CYP2D6DRD2
SCHEMBL14199982 0.81 DRD1 (0.75) DRD1DRD5CYP1A2CYP2D6DRD2
Bromide SCHEMBL11712496 0.78 KDM4E (0.68) DRD1CYP2D6DRD2HSD17B10THPO
SCHEMBL460269 0.78 DRD1 (0.64) DRD1DRD5CYP1A2CYP2D6DRD2
SCHEMBL11543046 0.77 CYP3A4 (0.69) CYP2D6CYP3A4
SCHEMBL14288500 0.77 SIGMAR1 (0.56) SIGMAR1LMNA
SCHEMBL462798 0.76 DRD1 (0.65) DRD1DRD5CYP1A2CYP2D6DRD2
SCHEMBL10800464 0.75 CYP3A4 (0.52) CYP2D6CYP3A4
SCHEMBL11105580 0.74 DRD1 (0.61) DRD1DRD5CYP1A2CYP2D6DRD2
Bromide SCHEMBL11721722 0.73 KDM4E (0.71) DRD1DRD5CYP2D6DRD2HSD17B10

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
US-9949983-B2 Fused benzazepines for treatment of stuttering PSYADON PHARMACEUTICALS, INC. (US) 2018-04-24 — — US disclosed
US-20160271141-A1 FUSED BENZAZEPINES FOR TREATMENT OF STUTTERING Psyadon Pharmaceuticals ,Inc. 2016-09-22 — — US disclosed
US-20150164911-A1 Fused Benzazepines for Treatment of Tourette's Syndrome HORIZON TECHNOLOGY FINANCE CORPORATION 2015-06-18 — — 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 (2 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-20160271141-A1 FUSED BENZAZEPINES FOR TREATMENT OF STUTTERING TACR1, AVPR1A, AVPR1B DRD1 28/4885DRD5 40/4885CYP1A2 704/4885
US-20150164911-A1 Fused Benzazepines for Treatment of Tourette's Syndrome COMT, SLC6A3, HTR3A DRD1 30/4885DRD5 39/4885CYP1A2 612/4885

“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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