SCHEMBL20150116

SCHEMBL20150116

COc1c(-c2ncn[nH]2)cccc1C(C)C

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.44
JAK1 P23458 1/20 0.38
TYK2 P29597 1/20 0.38
PIM1 P11309 6/20 0.36
PIM2 Q9P1W9 6/20 0.36
CSNK2B P67870 3/20 0.36
CSNK2A1 P68400 3/20 0.36
MAPK8 P45983 1/20 0.36
MAPK10 P53779 1/20 0.36
MAPT P10636 1/20 0.36
ENPP2 Q13822 1/20 0.36
BAD Q92934 1/20 0.34

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
SCHEMBL20150086 0.77 TAAR1 (0.46) IDO1
SCHEMBL20150091 0.77 TP53 (0.32) MAPT
SCHEMBL21375899 0.77 IDO1 (0.44) IDO1JAK1TYK2PIM1PIM2
SCHEMBL20150080 0.75 IDO1 (0.44) IDO1PIM1
SCHEMBL20150109 0.74 TSHR (0.38)
SCHEMBL20225753 0.73 BRD4 (0.33) MAPT
SCHEMBL20150120 0.73 TSHR (0.39) TYK2MAPT
SCHEMBL21784543 0.72 TEK (0.32)
SCHEMBL20150099 0.72 ROCK2 (0.44)
SCHEMBL20150087 0.72 TP53 (0.37) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220073527-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-03-10 US disclosed
US-11220508-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2022-01-11 US disclosed
US-11174265-B2 2021-11-16 US disclosed
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-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
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 (8 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-11220508-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 IDO1 429/4885JAK1 3/4885TYK2 1/4885
US-20210094948-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 IDO1 429/4885JAK1 3/4885TYK2 1/4885
US-10323036-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 IDO1 429/4885JAK1 3/4885TYK2 1/4885
US-20180134700-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 IDO1 429/4885JAK1 3/4885TYK2 1/4885
US-11174265-B2 TYK2, JAK2, JAK1 IDO1 686/4885JAK1 3/4885TYK2 1/4885
US-20180155349-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 IDO1 429/4885JAK1 3/4885TYK2 1/4885
US-10647713-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 IDO1 429/4885JAK1 3/4885TYK2 1/4885
US-20220073527-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 IDO1 429/4885JAK1 3/4885TYK2 1/4885

“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.