SCHEMBL20380485

SCHEMBL20380485

C[C@@]1(O)CCCN(c2cc[nH]n2)C1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.39
PIM1 P11309 5/20 0.39
MAP4K1 Q92918 2/20 0.35
JAK2 O60674 3/20 0.35
TYK2 P29597 3/20 0.35
KHK P50053 2/20 0.35
ALDH1A1 P00352 2/20 0.34
CYP2D6 P10635 2/20 0.34
HSD17B10 Q99714 2/20 0.34
MEN1 O00255 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
USP2 O75604 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
KIF18A Q8NI77 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
SCHEMBL18592814 1.00 LRRK2 (0.39) LRRK2PIM1MAP4K1JAK2TYK2
SCHEMBL18592872 0.91 KHK (0.41) LRRK2PIM1JAK2TYK2KHK
SCHEMBL18592869 0.91 KHK (0.41) LRRK2PIM1JAK2TYK2KHK
SCHEMBL18592873 0.91 KHK (0.41) LRRK2PIM1JAK2TYK2KHK
SCHEMBL18593005 0.81 LRRK2 (0.31) LRRK2JAK2TYK2KHK
SCHEMBL18593004 0.81 LRRK2 (0.31) LRRK2JAK2TYK2KHK
SCHEMBL18592840 0.78 JAK2 (0.38) LRRK2JAK2TYK2ALDH1A1CYP2D6
SCHEMBL18592978 0.78 JAK2 (0.39) LRRK2JAK2TYK2ALDH1A1CYP2D6
SCHEMBL18592837 0.78 JAK2 (0.38) LRRK2JAK2TYK2ALDH1A1CYP2D6
SCHEMBL18592838 0.78 JAK2 (0.38) LRRK2JAK2TYK2ALDH1A1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10023571-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2018-07-17 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 (1 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-10023571-B2 TYK2 inhibitors and uses thereof TYK2, JAK1, JAK2 LRRK2 259/4885PIM1 260/4885MAP4K1 163/4885

“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.