SCHEMBL9681229

SCHEMBL9681229

CCOC(=O)c1ccc2c(=O)c3ccccc3sc2c1C(=O)OCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
LMNA P02545 4/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
GAA P10253 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ALDH1A1 P00352 5/20 0.46
KMT2A Q03164 3/20 0.46
NOD2 Q9HC29 1/20 0.46
TSHR P16473 2/20 0.45
MAOB P27338 1/20 0.45
GABRP O00591 1/20 0.44
GABRD O14764 1/20 0.44
GABRA1 P14867 1/20 0.44
GABRB1 P18505 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44
GABRA2 P47869 1/20 0.44
GABRB2 P47870 1/20 0.44

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
SCHEMBL10727902 0.93 LMNA (0.46) MAPTLMNAL3MBTL1GAANPSR1
SCHEMBL10731867 0.88 TSHR (0.50) MAPTLMNAL3MBTL1ALDH1A1KMT2A
SCHEMBL9124986 0.86 ALDH1A1 (0.52) MAPTLMNAL3MBTL1ALDH1A1TSHR
SCHEMBL28837381 0.86 TSHR (0.53) MAPTLMNAL3MBTL1GAANPSR1
SCHEMBL9680549 0.84 CYP3A4 (0.49) MAPTLMNAL3MBTL1GAANPSR1
SCHEMBL52126 0.84 TSHR (0.46) MAPTLMNAL3MBTL1GAANPSR1
SCHEMBL29447786 0.84 TSHR (0.46) MAPTLMNAL3MBTL1GAANPSR1
SCHEMBL10730528 0.83 LMNA (0.54) MAPTLMNAL3MBTL1GAAALDH1A1
SCHEMBL29206737 0.83 LMNA (0.37) MAPTLMNAL3MBTL1GAANPSR1
SCHEMBL28837409 0.82 GABRP (0.47) MAPTLMNAL3MBTL1GAANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5145885-A Morpholine compound, binders CIBA-GEIGY CORPORATION (US) 1992-09-08 US disclosed
US-4992547-A Aminoaryl ketone photoinitiators CIBA-GEIGY CORPORATION (US) 1991-02-12 US disclosed
US-4681950-A PHOTOSENSITIZERS CIBA-GEIGY CORPORATION (US) 1987-07-21 US disclosed
US-4585876-A PHOTOSENSITIZERS CIBA-GEIGY CORPORATION (US) 1986-04-29 US disclosed
EP-0138754-A2 Photocurable compositions CIBA-GEIGY AG (CH) 1985-04-24 EP disclosed