SCHEMBL16807898

SCHEMBL16807898

Cc1cc2c(cc1O)CCNCC2c1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD1 P21728 16/20 0.80
▸ DRD2 P14416 9/20 0.80
▸ DRD5 P21918 5/20 0.80
▸ KDM4E B2RXH2 4/20 0.80
▸ HPGD P15428 3/20 0.80
▸ MAPT P10636 3/20 0.80
▸ ADCY5 O95622 2/20 0.80
▸ CYP3A4 P08684 2/20 0.80
▸ NFKB1 P19838 2/20 0.80
▸ THPO P40225 2/20 0.80
▸ HIF1A Q16665 2/20 0.80
▸ HSD17B10 Q99714 2/20 0.80
▸ ADCY6 O43306 1/20 0.80
▸ ADCY3 O60266 1/20 0.80
▸ ADCY9 O60503 1/20 0.80
▸ ADCY8 P40145 1/20 0.80
▸ ADCY7 P51828 1/20 0.80
▸ ADCY2 Q08462 1/20 0.80
▸ ADCY1 Q08828 1/20 0.80
▸ ADCY4 Q8NFM4 1/20 0.80

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
SCHEMBL10748648 0.95 DRD1 (0.80) DRD1DRD2DRD5KDM4EHPGD
Bromide SCHEMBL10746790 0.93 DRD1 (0.80) DRD1DRD2DRD5KDM4EHPGD
(R)-Skf-38393 SCHEMBL7941051 0.89 DRD1 (1.00) DRD1DRD2DRD5KDM4EHPGD
Skf-38393 SCHEMBL29389401 0.89 DRD1 (1.00) DRD1DRD2DRD5KDM4EHPGD
Skf-38393 SCHEMBL469578 0.89 DRD1 (1.00) DRD1DRD2DRD5KDM4EHPGD
Skf-38393 SCHEMBL3425787 0.87 DRD1 (1.00) DRD1DRD2DRD5KDM4EHPGD
(R)-Skf-38393 SCHEMBL7201583 0.87 DRD1 (1.00) DRD1DRD2DRD5KDM4EHPGD
Skf-38393 SCHEMBL1874365 0.87 DRD1 (1.00) DRD1DRD2DRD5KDM4EHPGD
(R)-Skf-38393 SCHEMBL7201396 0.87 DRD1 (1.00) DRD1DRD2DRD5KDM4EHPGD
Skf-38393 SCHEMBL29387587 0.87 DRD1 (1.00) DRD1DRD2DRD5KDM4EHPGD

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 28/4885DRD2 9/4885DRD5 40/4885
US-20150164911-A1 Fused Benzazepines for Treatment of Tourette's Syndrome COMT, SLC6A3, HTR3A DRD1 30/4885DRD2 8/4885DRD5 39/4885

“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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