SCHEMBL19635162

SCHEMBL19635162

CCOC(=O)c1c(Br)c(C)nn1CCN1CCOCC1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.47
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
RXFP1 Q9HBX9 2/20 0.42
POLB P06746 1/20 0.42
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 2/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 2/20 0.41
MAPK1 P28482 2/20 0.41
PIK3CA P42336 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 1/20 0.40
STAT3 P40763 1/20 0.40
RAB9A P51151 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL19635639 0.88 CYP3A4 (0.45) CYP3A4LMNASMN1; SMN2RXFP1POLB
SCHEMBL19615135 0.80 POLB (0.44) CYP3A4SMN1; SMN2RXFP1POLBALDH1A1
SCHEMBL19615856 0.78 CYP3A4 (0.45) CYP3A4LMNASMN1; SMN2RXFP1POLB
SCHEMBL19615376 0.78 L3MBTL1 (0.41) CYP3A4SMN1; SMN2RXFP1POLBALDH1A1
SCHEMBL20553377 0.78 ALDH1A1 (0.53) CYP3A4LMNASMN1; SMN2POLBALDH1A1
SCHEMBL19615236 0.77 LMNA (0.46) CYP3A4LMNASMN1; SMN2POLBALDH1A1
SCHEMBL19622608 0.76 KMT2A (0.37) LMNASMN1; SMN2POLBALDH1A1KDM4E
SCHEMBL7224541 0.75 POLB (0.47) RXFP1POLBALDH1A1KDM4EGAA
SCHEMBL24524686 0.73 MAPT (0.37) CYP3A4LMNASMN1; SMN2POLBALDH1A1
SCHEMBL19635528 0.73 POLB (0.47) CYP3A4LMNASMN1; SMN2RXFP1POLB

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 CYP3A4 598/4885LMNA 962/4885SMN1; SMN2 4099/4885
US-10981932-B2 Macrocyclic indole derivatives CCND2, IDO1, CCNT2 CYP3A4 362/4885LMNA 1055/4885SMN1; SMN2 4139/4885
US-20200087322-A1 MACROCYCLIC INDOLE DERIVATIVES CCND2, CCNA1, CCNT2 CYP3A4 625/4885LMNA 933/4885SMN1; SMN2 4202/4885

“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.