SCHEMBL7384927

SCHEMBL7384927

CCc1c(C(=O)OC)ncc2[nH]c3ccccc3c12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABRA1 P14867 16/20 0.68
▸ GABRG2 P18507 16/20 0.68
▸ GABRB3 P28472 16/20 0.68
▸ GABRA5 P31644 16/20 0.68
▸ GABRA3 P34903 16/20 0.68
▸ GABRA2 P47869 14/20 0.68
▸ GABRA6 Q16445 9/20 0.68
▸ GABRB2 P47870 8/20 0.68
▸ GABRP O00591 7/20 0.68
▸ GABRD O14764 7/20 0.68
▸ GABRB1 P18505 7/20 0.68
▸ GABRA4 P48169 7/20 0.68
▸ GABRE P78334 7/20 0.68
▸ GABRG1 Q8N1C3 7/20 0.68
▸ GABRG3 Q99928 7/20 0.68
▸ GABRQ Q9UN88 7/20 0.68
▸ MAPT P10636 5/20 0.67
▸ ALDH1A1 P00352 4/20 0.67
▸ KDM4E B2RXH2 4/20 0.67
▸ LMNA P02545 3/20 0.67

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
SCHEMBL7376252 0.90 GABRA1 (0.65) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL7383298 0.89 GABRA1 (0.81) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL10707914 0.89 GABRA1 (0.64) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL10711310 0.89 GABRA1 (0.81) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL7380291 0.88 GABRA1 (0.66) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL7381233 0.87 GABRA1 (0.65) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL7374058 0.87 GABRA1 (0.61) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL7384128 0.87 GABRA1 (0.67) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL7462942 0.86 GABRA1 (0.60) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL29507266 0.86 GABRA1 (0.59) GABRA1GABRG2GABRB3GABRA5GABRA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5010077-A Tranquilizers A/S FERROSAN (DK) 1991-04-23 — — US disclosed
EP-0030254-B1 BETA-CARBOLIN-3-CARBOXYLIC ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR THERAPEUTICAL USE SCHERING AKTIENGESELLSCHAFT (DE) 1984-10-31 — — EP disclosed
US-4371536-A TRANQUILIZERS A/S FERROSAN (DK) 1983-02-01 — — US disclosed
EP-0030254-A1 Beta-carbolin-3-carboxylic acid derivatives, pharmaceutical compositions containing them and their therapeutical use SCHERING AKTIENGESELLSCHAFT (DE) 1981-06-17 — — EP disclosed
Send feedback