SCHEMBL11295121

SCHEMBL11295121

S=C=Nc1ccc(Oc2ccc(N=C=S)cc2N=C=S)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 3/20 0.41
MIF P14174 1/20 0.41
FURIN P09958 1/20 0.41
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
PNMT P11086 1/20 0.35
HSD17B10 Q99714 4/20 0.34
CYP3A4 P08684 4/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
TDP1 Q9NUW8 3/20 0.34
KDM4E B2RXH2 2/20 0.34
USP2 O75604 2/20 0.34
LTA P01374 2/20 0.34
MAPT P10636 2/20 0.34
P2RX3 P56373 2/20 0.34
RAD51 Q06609 2/20 0.34
RAD1 O60671 1/20 0.34
ABCB11 O95342 1/20 0.31
NR3C1 P04150 1/20 0.31

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
SCHEMBL241344 0.81 CYP3A4 (0.51) FURINCYP3A4ALDH1A1HPGDTDP1
SCHEMBL11415006 0.80 APLNR (0.41) P2RY6MIFCA1CA2PNMT
SCHEMBL941550 0.78 MIF (0.56) P2RY6MIFFURINCA1CA2
SCHEMBL4739068 0.74 P2RY6 (0.46) P2RY6MIFCA1CA2PNMT
SCHEMBL15902917 0.73 MIF (0.44) MIFCYP3A4ALDH1A1MAPTCYP1A2
SCHEMBL166668 0.71 CYP3A4 (0.49) FURINCYP3A4ALDH1A1HPGDTDP1
SCHEMBL3823434 0.71 MIF (0.67) P2RY6MIFFURINCA1CA2
Bitoscanate SCHEMBL157128 0.71 MIF (0.72) P2RY6MIFCA1CA2PNMT
SCHEMBL2892989 0.70 ALDH1A1 (0.44) MIFHSD17B10CYP3A4ALDH1A1HPGD
SCHEMBL3542096 0.69 MAOA (0.48) P2RY6MIFCA1CA2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4316967-A EPOXIDIZED VINYL POLYMERS ENDCAPPED WITH POLYISOLYANATES OR POLYISOTHIOCYANTES THE FIRESTONE TIRE & RUBBER COMPANY (US) 1982-02-23 US disclosed
US-4299932-A ADDITION-CONDENSATION COPOLYMER OF A HYDROLYSED ISOCYANATE-AMIDE-MODIFIED DIENE, POLYURETHANE, AND POLYUREA THE FIRESTONE TIRE & RUBBER COMPANY (US) 1981-11-10 US disclosed
US-4298707-A ADDITION-CONDENSATION POLYMER FOAMS THE FIRESTONE TIRE & RUBBER COMPANY (US) 1981-11-03 US disclosed
US-4239860-A REACTING AMINE-TERMINATED ADDITION POLYMER WITH POLYURETHANE THE FIRESTONE TIRE & RUBBER COMPANY (US) 1980-12-16 US disclosed
US-4235979-A Amine terminated polymers and the formation of block copolymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1980-11-25 US disclosed
EP-0002196-A1 Amine terminated block copolymers and processes for their preparation THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-06-13 EP disclosed
US-4157430-A Amine terminated polymers and the formation of block copolymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-06-05 US disclosed
US-4157429-A Amine terminated polymers and the formation of block copolymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-06-05 US disclosed
US-4155947-A Amine terminated polymers and the formation of blocked copolymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-22 US disclosed
US-4155948-A Amine terminated polymers and the formation of blocked copolymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-22 US disclosed
US-4154913-A ADDITION POLYMER ENDCAPPED WITH POLYISOCYANATE THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-15 US disclosed
US-4154773-A UREA-ALDEHYDE POLYMER COUPLED TO ADDITION POLYMER THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-15 US disclosed
US-4154772-A PHENOLIC RESIN CONNECTED TO ADDITION POLYMER THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-15 US disclosed
US-4151222-A Amine terminated polymers and the formation of block copolymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-04-24 US disclosed
US-4070344-A WITH POLYISOCYANATE, AMIDE, HYDROLYSIS THE FIRESTONE TIRE AND RUBBER COMPANY (US) 1978-01-24 US disclosed