SCHEMBL21322343

SCHEMBL21322343

CC(C)CN1C[C@@H](N)CCC1=O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 5/20 0.50
POLB P06746 1/20 0.46
PER2 O15055 8/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
CRY2 Q49AN0 1/20 0.33
DPP4 P27487 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
SCHEMBL13623048 0.80 PIK3CD (0.52) PIK3CDPOLBPER2NPC1RAB9A
SCHEMBL14275822 0.79 TLR4 (0.31) NPC1RAB9A
SCHEMBL374144 0.76 POLB (0.33) POLBNPC1RAB9A
SCHEMBL974356 0.76 POLB (0.33) POLBNPC1RAB9A
SCHEMBL4760430 0.73 BRD4 (0.33) NPC1RAB9A
SCHEMBL4760434 0.72 KMT2A (0.38) NPC1RAB9A
SCHEMBL13647210 0.72 MAPT (0.43) POLBDPP4
SCHEMBL31291767 0.71 PER2 (0.32) PER2
Hydrochloric Acid SCHEMBL4339603 0.71 BRD4 (0.33) NPC1RAB9A
SCHEMBL13622593 0.71 SRD5A1 (0.59) PIK3CDPOLBPER2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212155-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. 2023-07-06 US disclosed
US-20230212155-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. 2023-07-06 US disclosed
US-20210053946-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. (US) 2021-02-25 US disclosed
US-10710986-B2 PD-1/PD-L1 inhibitors GILEAD SCIENCES, INC. (US) 2020-07-14 US disclosed
US-20190270727-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. 2019-09-05 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 (4 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-20230212155-A1 PD-1/PD-L1 INHIBITORS PDCD1, CD274, PDCD1LG2 PIK3CD 3024/4885POLB 382/4885PER2 4088/4885
US-20210053946-A1 PD-1/PD-L1 INHIBITORS PDCD1, CD274, PDCD1LG2 PIK3CD 3024/4885POLB 382/4885PER2 4088/4885
US-10710986-B2 PD-1/PD-L1 inhibitors PDCD1, CD274, PDCD1LG2 PIK3CD 3024/4885POLB 382/4885PER2 4088/4885
US-20190270727-A1 PD-1/PD-L1 INHIBITORS PDCD1, CD274, PDCD1LG2 PIK3CD 3024/4885POLB 382/4885PER2 4088/4885

“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.