SCHEMBL8359013

SCHEMBL8359013

O=C(Sc1ccccc1)c1ccc(C(=O)Sc2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
POLB P06746 1/20 0.48
HSP90AA1 P07900 1/20 0.48
HPGD P15428 4/20 0.48
ALDH1A1 P00352 4/20 0.48
CES2 O00748 4/20 0.46
CES1 P23141 3/20 0.46
TTR P02766 2/20 0.45
MAPT P10636 4/20 0.44
NPSR1 Q6W5P4 2/20 0.44
ESR1 P03372 1/20 0.44
FFAR1 O14842 1/20 0.43
DAO P14920 1/20 0.42
TSHR P16473 1/20 0.42
NAPRT Q6XQN6 1/20 0.42
SRD5A2 P31213 1/20 0.41
LMNA P02545 2/20 0.41
PLIN1 O60240 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL274958 0.95 TTR (0.49) NPC1RAB9APOLBHSP90AA1HPGD
SCHEMBL14567121 0.91 CES2 (0.54) NPC1RAB9APOLBHSP90AA1HPGD
SCHEMBL10226685 0.91 ALDH1A1 (0.58) NPC1RAB9APOLBHSP90AA1HPGD
SCHEMBL26038959 0.90 CES1 (0.48) NPC1RAB9APOLBHSP90AA1HPGD
SCHEMBL775576 0.89 NPC1 (0.64) NPC1RAB9APOLBHSP90AA1HPGD
SCHEMBL29763733 0.89 ALDH1A1 (0.47) NPC1RAB9APOLBHSP90AA1HPGD
SCHEMBL8400140 0.89 CES2 (0.55) HPGDALDH1A1CES2CES1MAPT
SCHEMBL29763732 0.84 CES2 (0.59) NPC1RAB9AHPGDALDH1A1CES2
SCHEMBL8866920 0.83 MAPT (0.61) NPC1RAB9APOLBHSP90AA1HPGD
SCHEMBL14599304 0.82 CES2 (0.54) NPC1RAB9APOLBHSP90AA1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5817430-A POLYARYLENEVINYLENE POLYMER XEROX CORPORATION (US) 1998-10-06 US claimed
US-5876865-A POLYARYLENEVINYLENE RESIN XEROX CORPORATION (US) 1999-03-02 US disclosed
US-5817430-A POLYARYLENEVINYLENE POLYMER XEROX CORPORATION (US) 1998-10-06 US disclosed
US-5703199-A Process for the preparation of nitrogen-containing polymers HOECHST AKTIENGESELLSCHAFT (DE) 1997-12-30 US disclosed
US-5128429-A Low temperature block polymerization without randomization RAYCHEM LIMITED (GB) 1992-07-07 US disclosed
EP-0154506-B1 PREPARATION OF ORGANIC POLYMERS RAYCHEM LIMITED (GB) 1992-02-05 EP disclosed
US-4999411-A Polythioethers, polythiocarbonates, polythioamides, polythioimides RAYCHEM LIMITED (GB) 1991-03-12 US disclosed
US-4960835-A ENGINEERING THERMOPLASTICS RAYCHEM LIMITED (GB) 1990-10-02 US disclosed
US-4845179-A CONDENSATION POLYMERIZATION RAYCHEM LIMITED (GB) 1989-07-04 US disclosed
EP-0154506-A2 Preparation of organic polymers RAYCHEM LIMITED (GB) 1985-09-11 EP disclosed