SCHEMBL16303829

SCHEMBL16303829

Cc1ccc2c(c1)c1cc(-c3ccc4c(c3)c3cc(C(C)(C)c5ccc(C(C)(C)C)cc5)ccc3n4C)ccc1n2C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.40
▸ BCHE P06276 1/20 0.39
▸ ACHE P22303 1/20 0.39
▸ SERPINE1 P05121 2/20 0.38
▸ ALDH1A1 P00352 6/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ APOBEC3G Q9HC16 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ NR1I2 O75469 1/20 0.35
▸ AHR P35869 1/20 0.35
▸ MAPT P10636 5/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.35
▸ APAF1 O14727 1/20 0.35

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
SCHEMBL16303830 0.94 TSHR (0.45) TSHRBCHEACHEALDH1A1KDM4E
SCHEMBL16303828 0.90 MAPT (0.39) TSHRBCHEACHESERPINE1ALDH1A1
SCHEMBL2604388 0.84 TSHR (0.46) TSHRBCHEACHEALDH1A1KDM4E
SCHEMBL16303827 0.84 BCHE (0.43) TSHRBCHEACHEALDH1A1KDM4E
SCHEMBL21454582 0.82 KIF11 (0.45) TSHRSERPINE1ALDH1A1KDM4ETDP1
SCHEMBL11998153 0.82 BCHE (0.50) BCHEACHEALDH1A1KDM4ETDP1
SCHEMBL14900745 0.82 BCHE (0.50) BCHEACHEALDH1A1KDM4ETDP1
SCHEMBL25490702 0.76 KIF11 (0.46) TSHRBCHEACHEALDH1A1KDM4E
SCHEMBL25917038 0.76 ALDH1A1 (0.47) BCHEACHEALDH1A1KDM4EHPGD
SCHEMBL25523207 0.75 GRM2 (0.44) SERPINE1ALDH1A1KDM4EMAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8993708-B2 Carbazole polymer NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-03-31 — — US disclosed
US-20140371421-A1 CARBAZOLE POLYMER NISSAN CHEMICAL INDUSTRIES, LTD (JP) 2014-12-18 — — US disclosed
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