SCHEMBL20116428

SCHEMBL20116428

CC(C)(C)OC(=O)N1CCC(c2nc(-c3ccn4cncc4c3)no2)CC1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.50
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.45
HDAC4 P56524 2/20 0.45
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
SMO Q99835 1/20 0.43

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
SCHEMBL20116965 0.87 GPR119 (0.50) GPR119SMN1; SMN2LMNATSHRHDAC4
SCHEMBL20116943 0.83 GPR119 (0.46) GPR119SMN1; SMN2LMNATSHRHDAC4
SCHEMBL390646 0.82 GPR119 (0.67) GPR119SMN1; SMN2LMNATSHRHTT
SCHEMBL20116149 0.81 GPR119 (0.45) GPR119SMN1; SMN2LMNATSHRHDAC4
SCHEMBL20117143 0.81 GPR119 (0.45) GPR119SMN1; SMN2LMNATSHRHDAC4
SCHEMBL20117162 0.81 SMN1; SMN2 (0.45) GPR119SMN1; SMN2LMNATSHRHDAC4
SCHEMBL12580569 0.81 SCD5 (0.59) GPR119LMNAHDAC4POLBSMO
SCHEMBL15560616 0.81 FASN (0.52) GPR119HTT
SCHEMBL1653518 0.81 TUBB4A (0.60) GPR119SMN1; SMN2LMNATSHRHDAC4
SCHEMBL23411281 0.81 GRM5 (0.60)

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 2922/4885SMN1; SMN2 13/4885LMNA 1966/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 GPR119 2922/4885SMN1; SMN2 13/4885LMNA 1966/4885

“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.