SCHEMBL8776923

SCHEMBL8776923

CC(C)c1cc(Cc2ccc(Oc3ccc(N)cc3)c(C(C)C)c2)ccc1Oc1ccc(N)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.41
P2RX3 P56373 1/20 0.40
P2RX2 Q9UBL9 1/20 0.40
HTR2A P28223 1/20 0.40
SLC6A4 P31645 1/20 0.40
KCNH2 Q12809 1/20 0.40
ALDH1A1 P00352 7/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TDP1 Q9NUW8 5/20 0.39
TSHR P16473 3/20 0.39
CYP3A4 P08684 2/20 0.39
CYP19A1 P11511 1/20 0.38
TEAD4 Q15561 1/20 0.38
THRB P10828 2/20 0.37
RORC P51449 1/20 0.37
MAPT P10636 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37
MITF O75030 1/20 0.37

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
SCHEMBL8581018 0.89 TSHR (0.41) P2RX3P2RX2ALDH1A1SMN1; SMN2TDP1
SCHEMBL8579754 0.87 ACACB (0.44) P2RX3P2RX2ALDH1A1TDP1TSHR
SCHEMBL8153194 0.87 TDP1 (0.39) GAAHTR2ASLC6A4KCNH2ALDH1A1
SCHEMBL9298705 0.85 ALDH1A1 (0.46) GAAP2RX3P2RX2ALDH1A1SMN1; SMN2
SCHEMBL31457302 0.85 ALDH1A1 (0.46) GAAP2RX3P2RX2ALDH1A1SMN1; SMN2
SCHEMBL8153814 0.79 P2RX3 (0.41) GAAP2RX3P2RX2ALDH1A1SMN1; SMN2
SCHEMBL2512315 0.79 ALDH1A1 (0.47) GAAALDH1A1SMN1; SMN2TDP1TSHR
SCHEMBL8145724 0.78 TSHR (0.50) GAAKCNH2ALDH1A1SMN1; SMN2TDP1
SCHEMBL8580831 0.78 TSHR (0.39) ALDH1A1SMN1; SMN2TDP1TSHRCYP3A4
SCHEMBL8152726 0.78 CA2 (0.61) GAAALDH1A1SMN1; SMN2TDP1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0604885-B1 Liquid crystal display device HOECHST AG (DE) 1997-12-10 EP disclosed
US-5670084-A Alignment layer material for liquid crystal display devices HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-23 US disclosed
US-5656340-A Liquid crystal display device HOECHST AKTIENGESELLSCHAFT (DE) 1997-08-12 US disclosed
EP-0708149-A1 Alignment layer material for liquid crystal display devices HOECHST AKTIENGESELLSCHAFT (DE) 1996-04-24 EP disclosed
EP-0690334-A2 Liquid crystal display device HOECHST AKTIENGESELLSCHAFT (DE) 1996-01-03 EP disclosed
US-5437813-A A thin alignment layer comprising an aromatic polyamide-polysiloxane block homo- or copolymer with different content of polysiloxane to adjust optical pretilt angle HOECHST AKTIENGESELLSCHAFT (DE) 1995-08-01 US disclosed
EP-0336536-B1 Organic-solvent soluble polyimide and production thereof HITACHI CHEMICAL CO LTD (JP) 1995-06-28 EP disclosed
EP-0604885-A1 Liquid crystal display device HOECHST AKTIENGESELLSCHAFT (DE) 1994-07-06 EP disclosed
US-5037862-A Excellent mechanical stability in printing HITACHI CHEMICAL COMPANY, LTD. (JP) 1991-08-06 US disclosed
US-4954612-A ORIENTATION CONTROL FOR LIQUID CRYSTAL DISPLAY HITACHI CHEMICAL CO., LTD. (JP) 1990-09-04 US disclosed
EP-0336536-A2 Organic-solvent soluble polyimide and production thereof Hitachi Chemical Co., Ltd. (JP) 1989-10-11 EP disclosed
US-4791157-A REACTING TRIMELLITIC ACID WITH AROMATIC DIAMINE WITH ETHER GROUPS HITACHI CHEMICAL CO. (JP) 1988-12-13 US disclosed
US-4758875-A Resin encapsulated semiconductor device HITACHI, LTD. (JP) 1988-07-19 US disclosed