SCHEMBL20073632

SCHEMBL20073632

CSc1cc(C2CCC2)ccc1N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.38
HDAC1 Q13547 6/20 0.36
HDAC2 Q92769 5/20 0.36
HDAC3 O15379 1/20 0.36
NOS3 P29474 2/20 0.35
NOS1 P29475 2/20 0.35
NOS2 P35228 2/20 0.35
ACMSD Q8TDX5 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 1/20 0.33
ESR2 Q92731 2/20 0.33
DRD2 P14416 1/20 0.32
DRD1 P21728 1/20 0.32
DRD4 P21917 1/20 0.32
DRD5 P21918 1/20 0.32
DRD3 P35462 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
KCNH2 Q12809 1/20 0.32

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
SCHEMBL11896445 0.95 BACE1 (0.44) BACE1HDAC1HDAC2HDAC3NOS3
SCHEMBL20073769 0.93 HDAC1 (0.38) BACE1HDAC1HDAC2HDAC3NOS3
SCHEMBL20150185 0.85 HTR1D (0.36) HDAC1HDAC2HDAC3NPC1RAB9A
SCHEMBL29653784 0.77 BACE1 (0.44) BACE1HDAC1HDAC2HDAC3ACMSD
SCHEMBL9108966 0.77 BACE1 (0.44) BACE1HDAC1HDAC2HDAC3ACMSD
SCHEMBL22298075 0.76 CYP3A4 (0.45) BACE1HDAC1HDAC2HDAC3ACMSD
SCHEMBL20073550 0.75 BACE1 (0.36) BACE1HDAC1HDAC2HDAC3NOS3
SCHEMBL15156130 0.72 BACE1 (0.49) BACE1HDAC1HDAC2HDAC3ACMSD
SCHEMBL20150183 0.72 MAPT (0.37) RAB9AMEN1KMT2A
SCHEMBL3789570 0.72 SLC6A2 (0.46) BACE1HDAC1HDAC2HDAC3ACMSD

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 16 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-20210230163-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-07-29 US disclosed
EP-3848370-A2 TYK2 INHIBITORS AND USES THEREOF Nimbus Lakshmi, Inc. (US) 2021-07-14 EP disclosed
US-20210094948-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-04-01 US disclosed
US-10793574-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2020-10-06 US disclosed
US-10647713-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2020-05-12 US disclosed
US-20190284194-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-09-19 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
WO-2018075937-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2018-04-26 WO disclosed
WO-2018071794-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2018-04-19 WO 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 (11 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 BACE1 4408/4885HDAC1 2265/4885HDAC2 926/4885
US-20210094948-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 BACE1 4408/4885HDAC1 2265/4885HDAC2 926/4885
US-10793574-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 BACE1 4408/4885HDAC1 2265/4885HDAC2 926/4885
US-10323036-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 BACE1 4408/4885HDAC1 2265/4885HDAC2 926/4885
US-20210230163-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 BACE1 4408/4885HDAC1 2265/4885HDAC2 926/4885
US-20180134700-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 BACE1 4408/4885HDAC1 2265/4885HDAC2 926/4885
US-20190284194-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 BACE1 4408/4885HDAC1 2265/4885HDAC2 926/4885
US-11174265-B2 TYK2, JAK2, JAK1 BACE1 4484/4885HDAC1 1463/4885HDAC2 569/4885
US-20180155349-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 BACE1 4408/4885HDAC1 2265/4885HDAC2 926/4885
US-10647713-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 BACE1 4408/4885HDAC1 2265/4885HDAC2 926/4885
US-20220073527-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 BACE1 4408/4885HDAC1 2265/4885HDAC2 926/4885

“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.