SCHEMBL30429792

SCHEMBL30429792

CC(C)(C)[C@@]1(C(=O)O)CNC(=O)N1C(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GLA P06280 1/20 0.39
CTRB1 P17538 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
P2RX4 Q99571 2/20 0.39
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
CYP2C19 P33261 1/20 0.38
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38

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
SCHEMBL6001297 0.81 HTR2C (0.47) HTR2CSMN1; SMN2NPC1RAB9AGAA
SCHEMBL7264096 0.81 HTR2C (0.47) HTR2CSMN1; SMN2NPC1RAB9AGAA
SCHEMBL11285680 0.79 HTR2C (0.45) HTR2CSMN1; SMN2NPC1RAB9AGAA
SCHEMBL7270210 0.78 NPC1 (0.45) HTR2CSMN1; SMN2NPC1RAB9AGAA
SCHEMBL1508854 0.75 HTR2C (0.52) HTR2CSMN1; SMN2NPC1RAB9AGAA
SCHEMBL6434232 0.74 MEN1 (0.41) HTR2CSMN1; SMN2NPC1RAB9AMEN1
Hydrochloric Acid SCHEMBL17459607 0.73
SCHEMBL1508493 0.73 HTR2C (0.44) HTR2CSMN1; SMN2NPC1RAB9AGAA
SCHEMBL1509134 0.73 SMN1; SMN2 (0.45) HTR2CSMN1; SMN2NPC1RAB9AGAA
SCHEMBL1508943 0.73 HTR2C (0.44) HTR2CSMN1; SMN2NPC1RAB9AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250066368-A1 DNA POLYMERASE THETA INHIBITOR AND USE THEREOF SHANGHAI APEIRON THERAPEUTICS COMPANY LIMITED (CN) 2025-02-27 US disclosed
EP-4455129-A1 DNA POLYMERASE THETA INHIBITOR AND USE THEREOF Shanghai Apeiron Therapeutics Company Limited (CN) 2024-10-30 EP disclosed
WO-2023125918-A1 DNA POLYMERASE THETA INHIBITOR AND USE THEREOF 上海湃隆生物科技有限公司 2023-07-06 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 (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-20250066368-A1 DNA POLYMERASE THETA INHIBITOR AND USE THEREOF POLQ, POLB, POLM HTR2C 4394/4885SMN1; SMN2 2924/4885NPC1 3569/4885

“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.