SCHEMBL20116155

SCHEMBL20116155

CC(C)n1ncc2ccc(-c3noc(C4(F)CCN(C(=O)OC5CC5)CC4)n3)cc21

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.36
PTGER3 P43115 1/20 0.35
KIT P10721 1/20 0.35
GRM5 P41594 3/20 0.34
SMO Q99835 2/20 0.34
HRH3 Q9Y5N1 9/20 0.34
ACACB O00763 1/20 0.33
ABCB11 O95342 1/20 0.33
ABCC1 P33527 1/20 0.33
ACACA Q13085 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
SLCO1B1 Q9Y6L6 1/20 0.33
ROCK2 O75116 1/20 0.33
PIK3CD O00329 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
SCHEMBL20116152 0.90 KIT (0.40) PTGER3KITSMOACACBABCB11
SCHEMBL22357933 0.88 HDAC4 (0.43) GPR119
SCHEMBL20116156 0.88 KIT (0.36) GPR119PTGER3KITGRM5SMO
SCHEMBL22357940 0.84 PLA2G2A (0.36) KITSMO
SCHEMBL22358278 0.83 SMO (0.49) SMO
SCHEMBL20117145 0.83 MAPT (0.48) HRH3
SCHEMBL22357929 0.83 KIT (0.36) PTGER3KITSMOACACBABCB11
SCHEMBL20116148 0.83 KIT (0.36) PTGER3KITGRM5SMOACACB
SCHEMBL20116708 0.81 KIT (0.37) PTGER3KITSMOPIK3CD
SCHEMBL22357935 0.79 PIK3CD (0.36) PTGER3KITGRM5PIK3CD

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
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-20200262828-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2020-08-20 US disclosed
WO-2019209948-A9 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-01-02 WO disclosed
WO-2019018795-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2019-01-24 WO disclosed
WO-2018081167-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2018-05-03 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 (2 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-11873298-B2 Compounds and uses thereof NLN, ACHE, CLN6 GPR119 2922/4885PTGER3 1760/4885KIT 4491/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 GPR119 2922/4885PTGER3 1760/4885KIT 4491/4885

“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.