Benzene

Benzene

SCHEMBL21800969

c1ccc2c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccccc3cc2c1.c1ccccc1

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.57
▸ KDM4E B2RXH2 2/20 0.57
▸ ATM Q13315 1/20 0.57
▸ ALOX5 P09917 3/20 0.46
▸ KMT2A Q03164 3/20 0.43
▸ HDAC4 P56524 1/20 0.42
▸ ESR1 P03372 3/20 0.38
▸ ESR2 Q92731 3/20 0.38
▸ PTPN1 P18031 2/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ TSHR P16473 1/20 0.37
▸ EDNRA P25101 2/20 0.36
▸ EDNRB P24530 1/20 0.36
▸ IL1R1 P14778 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ CYP1A2 P05177 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ HPGD P15428 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
SCHEMBL9890864 0.98 KDM4E (0.53) L3MBTL1KDM4EATMALOX5KMT2A
SCHEMBL16521307 0.91 L3MBTL1 (0.47) L3MBTL1KDM4EATMALOX5KMT2A
SCHEMBL14510030 0.90 KDM4E (0.48) L3MBTL1KDM4EATMALOX5KMT2A
Benzene SCHEMBL5468284 0.90 KDM4E (0.46) L3MBTL1KDM4EATMALOX5KMT2A
Benzene SCHEMBL21800968 0.89 L3MBTL1 (0.53) L3MBTL1KDM4EATMALOX5KMT2A
SCHEMBL9890872 0.89 L3MBTL1 (0.53) L3MBTL1KDM4EATMALOX5KMT2A
SCHEMBL25658202 0.89 L3MBTL1 (0.49) L3MBTL1KDM4EATMALOX5KMT2A
SCHEMBL24812015 0.87 KMT2A (0.44) L3MBTL1KDM4EATMALOX5KMT2A
SCHEMBL28009925 0.86 L3MBTL1 (0.52) L3MBTL1KDM4EATMALOX5KMT2A
SCHEMBL17711498 0.86 KDM4E (0.44) L3MBTL1KDM4EATMALOX5KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020053689-A1 LIGHT-EMITTING DEVICE, LIGHT-EMITTING APPARATUS, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2020-03-19 — — WO disclosed
Send feedback