SCHEMBL2515402

SCHEMBL2515402

NC(=S)N(CCc1cnc2ccccc2n1)c1ccccn1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 13/20 0.49
▸ HTR1A P08908 3/20 0.40
▸ DRD4 P21917 3/20 0.40
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ TSHR P16473 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HIF1A Q16665 1/20 0.33

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
SCHEMBL7029896 0.73 PDE10A (0.38) PDE10AMEN1KMT2AMAPT
SCHEMBL11405556 0.70 CYP2D6 (0.41) MEN1KMT2ATSHR
SCHEMBL31213551 0.70 POLB (0.43) MEN1KMT2AMAPTTSHR
SCHEMBL28002004 0.70 PDE10A (0.78) PDE10AMEN1KMT2AMAPTCYP1A2
SCHEMBL12066225 0.69 PDE10A (1.00) PDE10AMEN1KMT2AMAPT
SCHEMBL2515397 0.67 KDM4E (0.47) HTR1ADRD4MEN1KMT2AMAPT
SCHEMBL8408826 0.66 PDE10A (0.77) PDE10AMEN1KMT2AMAPT
SCHEMBL7317281 0.66 PDE10A (0.77) PDE10AMEN1KMT2AMAPTCYP1A2
SCHEMBL12471341 0.66 PDE10A (0.77) PDE10AMEN1KMT2AMAPT
SCHEMBL5659096 0.66 PDE10A (0.65) PDE10AHTR1AMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2114948-B1 INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE ABBVIE INC (US) 2014-06-25 — — EP disclosed
US-8030047-B2 Active truncated form of the RNA polymerase of flavivirus CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE-CNRS (FR) 2011-10-04 — — US disclosed
US-20100267113-A1 ACTIVE TRUNCATED FORM OF THE RNA POLYMERASE OF FLAVIVIRUS CENTRE NAT DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-10-21 — — US disclosed
US-20090221795-A1 ACTIVE TRUNCATED FORM OF THE RNA POLYMERASE OF FLAVIVIRUS CENTRE NAT DE LA RECHERCHE SCIENTIFIQUE (FR) 2009-09-03 — — US disclosed
US-7459297-B2 Active truncated form of the RNA polymerase of flavivirus CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE -CNRS (FR) 2008-12-02 — — US disclosed
US-20050048472-A1 Active truncated form of the RNA polymerase of flavivirus CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE-CNRS (FR) 2005-03-03 — — US disclosed
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