SCHEMBL19635164

SCHEMBL19635164

CCOC(=O)c1cc(C2CC2)nn1CC

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.45
POLB P06746 2/20 0.45
TDP1 Q9NUW8 4/20 0.43
KDM4E B2RXH2 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.40
ALDH1A1 P00352 3/20 0.40
DRD3 P35462 2/20 0.38
DHODH Q02127 1/20 0.37

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
SCHEMBL25470787 0.89 SMN1; SMN2 (0.43) FAAHSMN1; SMN2POLBTDP1KDM4E
SCHEMBL2363430 0.84 FAAH (0.49) FAAHSMN1; SMN2POLBKDM4EHSD17B10
SCHEMBL27166501 0.83 SMN1; SMN2 (0.69) SMN1; SMN2POLBTDP1L3MBTL1RAB9A
SCHEMBL16418231 0.82 KCNJ6 (0.39) POLBMAPT
SCHEMBL23012314 0.80 KDM4E (0.40) FAAHSMN1; SMN2POLBTDP1KDM4E
SCHEMBL17162239 0.79 FAAH (0.50) FAAHSMN1; SMN2POLBKDM4EHSD17B10
SCHEMBL3997610 0.79 PSMB8 (0.53) FAAHSMN1; SMN2POLBKDM4EHSD17B10
SCHEMBL6188814 0.79 MAPT (0.52) FAAHSMN1; SMN2POLBTDP1RAB9A
SCHEMBL25111076 0.78 PSMB8 (0.41)
SCHEMBL25169810 0.78 FAAH (0.39) FAAHSMN1; SMN2POLBKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11492358-B1 Macrocyclic indole derivatives THE BROAD INSTITUTE, INC. (US) 2022-11-08 US disclosed
EP-3458459-B1 MACROCYCLIC INDOLE DERIVATIVES BAYER AG (DE) 2022-04-27 EP disclosed
EP-3458459-B1 MACROCYCLIC INDOLE DERIVATIVES BAYER AG (DE) 2022-04-27 EP disclosed
CN-109715632-B Macrocyclic indole derivatives 拜尔公开股份有限公司 2021-10-26 CN disclosed
US-10981932-B2 Macrocyclic indole derivatives BAYER AKTIENGESELLSCHAFT (DE) 2021-04-20 US disclosed
US-10981932-B2 Macrocyclic indole derivatives BAYER AKTIENGESELLSCHAFT (DE) 2021-04-20 US disclosed
US-20200087322-A1 MACROCYCLIC INDOLE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-03-19 US disclosed
WO-2017198341-A1 MACROCYCLIC INDOLE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2017-11-23 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 (3 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-11492358-B1 Macrocyclic indole derivatives CCND2, CCNT2, IDO1 FAAH 4071/4885SMN1; SMN2 4099/4885POLB 2024/4885
US-10981932-B2 Macrocyclic indole derivatives CCND2, IDO1, CCNT2 FAAH 3894/4885SMN1; SMN2 4139/4885POLB 2267/4885
US-20200087322-A1 MACROCYCLIC INDOLE DERIVATIVES CCND2, CCNA1, CCNT2 FAAH 4055/4885SMN1; SMN2 4202/4885POLB 2027/4885

“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.