SCHEMBL20155920

SCHEMBL20155920

CCc1cccc(-n2cccn2)c1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPBWR1 P48145 1/20 0.46
NPC1 O15118 2/20 0.44
MAPK1 P28482 1/20 0.44
HCRTR1 O43613 6/20 0.38
HCRTR2 O43614 6/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
G6PD P11413 1/20 0.38
TYK2 P29597 1/20 0.37
CHRNA7 P36544 1/20 0.36
CHRNA10 Q9GZZ6 1/20 0.36
CHRNA9 Q9UGM1 1/20 0.36
CHRM1 P11229 1/20 0.36
PKM P14618 1/20 0.36
MPO P05164 1/20 0.35

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
SCHEMBL12481069 0.82 MAPK1 (0.53) NPBWR1NPC1MAPK1HCRTR1HCRTR2
SCHEMBL20230855 0.81 NOTUM (0.47) HCRTR1HCRTR2
SCHEMBL9342233 0.80 TSHR (0.49) HCRTR1HCRTR2MAPTKDM4EALDH1A1
SCHEMBL16964622 0.80 NPC1 (0.47) NPBWR1NPC1MAPK1HCRTR1HCRTR2
SCHEMBL20155918 0.80 HCRTR1 (0.38) NPBWR1HCRTR1HCRTR2MEN1KMT2A
SCHEMBL24498386 0.78 KDM4E (0.51) NPBWR1NPC1MAPK1HCRTR1HCRTR2
SCHEMBL15690544 0.78 NPC1 (0.46) NPBWR1NPC1MAPK1HCRTR1HCRTR2
SCHEMBL20230882 0.77 NPBWR1 (0.35) NPBWR1NPC1MAPK1HCRTR1HCRTR2
SCHEMBL20150084 0.76 NPC1 (0.44) NPBWR1NPC1MAPK1HCRTR1HCRTR2
SCHEMBL24026794 0.76 NPC1 (0.44) NPBWR1NPC1MAPK1MEN1MAPT

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
US-20210094948-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-04-01 US disclosed
US-10647713-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2020-05-12 US disclosed
US-10323036-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2019-06-18 US disclosed
US-20180155349-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-06-07 US disclosed
US-20180134700-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-05-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210094948-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 NPBWR1 3829/4885NPC1 4595/4885MAPK1 541/4885
US-10323036-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 NPBWR1 3829/4885NPC1 4595/4885MAPK1 541/4885
US-20180134700-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 NPBWR1 3829/4885NPC1 4595/4885MAPK1 541/4885
US-20180155349-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 NPBWR1 3829/4885NPC1 4595/4885MAPK1 541/4885
US-10647713-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 NPBWR1 3829/4885NPC1 4595/4885MAPK1 541/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.