SCHEMBL29357331

SCHEMBL29357331

CC(C)(C)OC(=O)N1CCc2[nH]c3ccccc3c2C1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.69
LMNA P02545 2/20 0.69
BAZ2B Q9UIF8 1/20 0.69
TRPV1 Q8NER1 3/20 0.57
TAAR1 Q96RJ0 1/20 0.57
KMT2A Q03164 3/20 0.56
FAAH O00519 2/20 0.56
ALDH1A1 P00352 4/20 0.55
CASP1 P29466 3/20 0.55
KDM4E B2RXH2 3/20 0.55
ATM Q13315 2/20 0.55
MEN1 O00255 2/20 0.55
MAPK1 P28482 1/20 0.55
HSD17B10 Q99714 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
MCL1 Q07820 1/20 0.55

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
SCHEMBL2241936 1.00 MAPT (0.69) MAPTLMNABAZ2BTRPV1TAAR1
Acetic Acid SCHEMBL8714196 0.96 MAPT (0.68) MAPTLMNABAZ2BTRPV1TAAR1
SCHEMBL4540180 0.93 MAPT (0.59) MAPTLMNABAZ2BTRPV1TAAR1
SCHEMBL6474214 0.91 LMNA (0.60) MAPTLMNABAZ2BTRPV1TAAR1
SCHEMBL350201 0.90 TRPV1 (0.69) MAPTLMNABAZ2BTRPV1FAAH
SCHEMBL21154454 0.89 LMNA (0.55) MAPTLMNABAZ2BTRPV1KMT2A
Acetic Acid SCHEMBL8718251 0.87 TRPV1 (0.68) MAPTLMNABAZ2BTRPV1FAAH
SCHEMBL24405315 0.86 MAPT (0.74) MAPTLMNABAZ2BTRPV1TAAR1
SCHEMBL24914458 0.86 MTHFD2 (0.60) MAPTLMNABAZ2BTRPV1FAAH
SCHEMBL31117573 0.86 LMNA (0.55) MAPTLMNABAZ2BTRPV1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025041160-A1 BIFUNCTIONAL CONJUGATE MOLECULES FOR CANCER TREATMENT AND PROCESS OF MAKING THE SAME BIRLA INSTITUTE OF TECHNOLOGY AND SCIENCE (BITS), PILANI (IN) 2025-02-27 WO disclosed
CN-113121527-B Tricyclic compounds and uses thereof 上海辉启生物医药科技有限公司 2024-09-06 CN disclosed
CN-117794525-A Anticancer compounds 加利福尼亚大学董事会 2024-03-29 CN disclosed
CN-109928971-B Aryl substituted aminotetrahydropyrans and uses thereof 广东东阳光药业股份有限公司 2024-01-16 CN disclosed
CN-111757882-B Compounds for treating, alleviating or preventing conditions associated with tau aggregates AC免疫有限公司 2023-08-22 CN disclosed
WO-2022194087-A1 MODIFIED PROTEINS AND PROTEIN BINDERS CULLGEN (SHANGHAI) , INC. (CN) 2022-09-22 WO disclosed
EP-3941477-A1 NOVEL COMPOUNDS FOR THE TREATMENT, ALLEVIATION OR PREVENTION OF DISORDERS ASSOCIATED WITH TAU AGGREGATES AC Immune SA (CH) 2022-01-26 EP disclosed