SCHEMBL11207111

SCHEMBL11207111

[Li]c1cccc2c1-c1ccccc1-2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.38
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
ATM Q13315 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
PTPRC P08575 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CES2 O00748 1/20 0.35
APAF1 O14727 1/20 0.35
TERT O14746 1/20 0.35
NPC1 O15118 1/20 0.35
PLIN1 O60240 1/20 0.35
TDP2 O95551 1/20 0.35
S1PR4 O95977 1/20 0.35
PLA2G1B P04054 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
SCHEMBL28899585 0.79 TSHR (0.38) TSHRNPC1RAB9ASMN1; SMN2CYP3A4
SCHEMBL29236876 0.78 ALDH1A1 (0.47) MAPK1ALDH1A1TSHRATMHSD17B10
SCHEMBL8415700 0.76 DNMT1 (0.34) MAPK1ALDH1A1TSHRATMHSD17B10
SCHEMBL2783552 0.72 KMT2A (0.39) MAPK1ALDH1A1TSHRATMHSD17B10
SCHEMBL29962090 0.72 KMT2A (0.39) MAPK1ALDH1A1TSHRATMHSD17B10
SCHEMBL3859593 0.71 MEN1 (0.57) MAPK1ALDH1A1TSHRATMHSD17B10
SCHEMBL11899801 0.69 ALDH1A1 (0.39) MAPK1ALDH1A1TSHRATMHSD17B10
SCHEMBL3898948 0.69 ALDH1A1 (0.39) MAPK1ALDH1A1TSHRATMHSD17B10
SCHEMBL6535680 0.69 ALDH1A1 (0.39) MAPK1ALDH1A1TSHRATMHSD17B10
SCHEMBL3891682 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0096723-A1 BATTERIES FABRICATED WITH ELECTROACTIVE POLYMERS. CHEVRON RES (US) 1983-12-28 EP claimed
WO-1983002368-A1 BATTERIES FABRICATED WITH ELECTROACTIVE POLYMERS CHEVRON RES (US) 1983-07-07 WO claimed
CN-114175293-A Bispyrans, dithiodipyrans and diseleno-dipyrans and use thereof 塞勒锐科有限公司 2022-03-11 CN disclosed