SCHEMBL8499397

SCHEMBL8499397

CCCNCCCCCCCCCCCCCCCCCCN

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.65
CA12 O43570 2/20 0.65
F13A1 P00488 2/20 0.65
CA2 P00918 2/20 0.65
CYP1A2 P05177 2/20 0.65
ALOX15 P16050 2/20 0.65
CA4 P22748 2/20 0.65
CA6 P23280 2/20 0.65
CA5A P35218 2/20 0.65
THPO P40225 2/20 0.65
CA7 P43166 2/20 0.65
CA9 Q16790 2/20 0.65
CA14 Q9ULX7 2/20 0.65
CA5B Q9Y2D0 2/20 0.65
CA1 P00915 1/20 0.65
CA3 P07451 1/20 0.65
CYP2C9 P11712 1/20 0.65
PKM P14618 1/20 0.65
MTOR P42345 1/20 0.65
LMNA P02545 1/20 0.62

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
SCHEMBL8499241 1.00 TSHR (0.65) TSHRCA12F13A1CA2CYP1A2
SCHEMBL11754616 1.00 TSHR (0.65) TSHRCA12F13A1CA2CYP1A2
SCHEMBL4256739 1.00 TSHR (0.65) TSHRCA12F13A1CA2CYP1A2
SCHEMBL16269067 1.00 TSHR (0.65) TSHRCA12F13A1CA2CYP1A2
SCHEMBL8423655 1.00 TSHR (0.65) TSHRCA12F13A1CA2CYP1A2
SCHEMBL21794160 1.00 TSHR (0.65) TSHRCA12F13A1CA2CYP1A2
SCHEMBL21799619 1.00 TSHR (0.65) TSHRCA12F13A1CA2CYP1A2
SCHEMBL21799712 1.00 TSHR (0.65) TSHRCA12F13A1CA2CYP1A2
SCHEMBL21799791 1.00 TSHR (0.65) TSHRCA12F13A1CA2CYP1A2
SCHEMBL309583 0.97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0558048-B1 Thermoplastic resin composition IDEMITSU PETROCHEMICAL CO (JP) 1999-07-07 EP disclosed
EP-0558047-B1 Copolymer having amino group and process for production thereof DAI ICHI KOGYO SEIYAKU CO LTD (JP) 1998-05-20 EP disclosed
US-5552480-A BLEND, IMIDIZED ADDITION POLYMER, ENGINEERING PLASTIC, IMPACT STRENGTH IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1996-09-03 US disclosed
EP-0558047-A2 Copolymer having amino group and process for production thereof DAI-ICHI KOGYO SEIYAKU Co., Ltd. (JP) 1993-09-01 EP disclosed
EP-0558048-A1 Thermoplastic resin composition IDEMITSU PETROCHEMICAL COMPANY LIMITED (JP) 1993-09-01 EP disclosed