SCHEMBL24253629

SCHEMBL24253629

O=C1CCCC2(CCN(c3nn[nH]n3)CC2)N1c1ccc(Cl)c(F)c1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAD51 Q06609 1/20 0.33
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
MMP2 P08253 2/20 0.32
ADAMTS5 Q9UNA0 2/20 0.32
CYP11B2 P19099 1/20 0.31
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31
FABP4 P15090 1/20 0.30
FABP5 Q01469 1/20 0.30
MMP13 P45452 1/20 0.30

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
SCHEMBL30424017 0.82 RAD51 (0.33) RAD51IDO1TDO2MMP2ADAMTS5
SCHEMBL24253726 0.81 DPP4 (0.36) RAD51MMP2ADAMTS5CYP11B2HCRTR1
SCHEMBL30423561 0.81 DPP4 (0.36) RAD51MMP2ADAMTS5CYP11B2HCRTR1
SCHEMBL30424173 0.80 RAD51 (0.31) RAD51
SCHEMBL24253921 0.80 RAD51 (0.31) RAD51
SCHEMBL24253627 0.79 IDO1 (0.34) RAD51IDO1TDO2MMP2ADAMTS5
SCHEMBL30423967 0.79 RAD51 (0.31) RAD51
SCHEMBL24253919 0.79 RAD51 (0.31) RAD51
SCHEMBL30424392 0.79 SCD (0.35) RAD51CYP11B2HCRTR1HCRTR2
SCHEMBL24253923 0.78 RAD51 (0.33) RAD51IDO1TDO2CYP11B2HCRTR1

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-11708366-B2 Heteroaryl substituted spiropiperidinyl derivatives and pharmaceutical uses thereof NOVARTIS AG (CH) 2023-07-25 US disclosed
US-11708366-B2 Heteroaryl substituted spiropiperidinyl derivatives and pharmaceutical uses thereof NOVARTIS AG (CH) 2023-07-25 US disclosed
US-20220048909-A1 HETEROARYL SUBSTITUTED SPIROPIPERIDINYL DERIVATIVES AND PHARMACEUTICAL USES THEREOF NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2022-02-17 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 (2 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-11708366-B2 Heteroaryl substituted spiropiperidinyl derivatives and pharmaceutical uses thereof REN, NR3C2, PKD1 RAD51 3303/4885IDO1 3523/4885TDO2 4501/4885
US-20220048909-A1 HETEROARYL SUBSTITUTED SPIROPIPERIDINYL DERIVATIVES AND PHARMACEUTICAL USES THEREOF REN, NR3C2, PKD1 RAD51 3303/4885IDO1 3523/4885TDO2 4501/4885

“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.