Bromobenzene

Bromobenzene

SCHEMBL28019698

Brc1ccccc1.c1ccc(N2CCCCC2)cc1

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.50
MBTD1 Q05BQ5 1/20 0.50
L3MBTL3 Q96JM7 1/20 0.50
ALDH1A1 P00352 5/20 0.48
MAPT P10636 5/20 0.48
ALOX15 P16050 4/20 0.48
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
LMNA P02545 3/20 0.48
HSD17B10 Q99714 3/20 0.48
TP53 P04637 3/20 0.48
HPGD P15428 2/20 0.48
TSHR P16473 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
STAT1 P42224 1/20 0.48
HTR3E A5X5Y0 1/20 0.48
HTR3B O95264 1/20 0.48
ADRB1 P08588 1/20 0.48
HTR3A P46098 1/20 0.48
HTR3D Q70Z44 1/20 0.48

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
SCHEMBL8542780 0.89 L3MBTL1 (0.59) L3MBTL1MBTD1L3MBTL3ALDH1A1MAPT
Benzene SCHEMBL28818227 0.89 L3MBTL1 (0.59) L3MBTL1MBTD1L3MBTL3ALDH1A1MAPT
SCHEMBL1968506 0.89 L3MBTL1 (0.59) L3MBTL1MBTD1L3MBTL3ALDH1A1MAPT
SCHEMBL93630 0.89 L3MBTL1 (0.59) L3MBTL1MBTD1L3MBTL3ALDH1A1MAPT
SCHEMBL2312380 0.89 L3MBTL1 (0.59) L3MBTL1MBTD1L3MBTL3ALDH1A1MAPT
Water SCHEMBL10922019 0.86 L3MBTL1 (0.57) L3MBTL1MBTD1L3MBTL3ALDH1A1MAPT
Hydrochloric Acid SCHEMBL9291151 0.86 ALDH1A1 (0.60) L3MBTL1MBTD1L3MBTL3ALDH1A1MAPT
Hydrochloric Acid SCHEMBL5417163 0.86 ALDH1A1 (0.60) L3MBTL1MBTD1L3MBTL3ALDH1A1MAPT
Bromide SCHEMBL28856450 0.86 L3MBTL1 (0.57) L3MBTL1MBTD1L3MBTL3ALDH1A1MAPT
SCHEMBL18228234 0.86 L3MBTL1 (0.61) L3MBTL1MBTD1L3MBTL3ALDH1A1MAPT

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
CN-109810047-A (R) synthetic method of the chiral intermediate of -3- Phenylpiperidine or/and (S) -3- Phenylpiperidine and Ni Lapani 上海博邦医药科技有限公司 2019-05-28 CN disclosed
CN-104684888-A Fluorene compound, photopolymerization initiator containing the fluorene compound, and photosensitive composition containing the photopolymerization initiator DAITO CHEMIX CORP 2015-06-03 CN disclosed