SCHEMBL24253912

SCHEMBL24253912

O=C1CC(F)CC2(CCNCC2)N1c1ccc(F)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 1/20 0.37
TSHR P16473 1/20 0.37
HTR1A P08908 1/20 0.32
DRD2 P14416 1/20 0.32
ADRA1D P25100 1/20 0.32
ADRA1A P35348 1/20 0.32
ADRA1B P35368 1/20 0.32
ROCK2 O75116 1/20 0.32
RAF1 P04049 1/20 0.31
BRAF P15056 1/20 0.31
CYP11B2 P19099 1/20 0.31
MMP13 P45452 1/20 0.30
ADAMTS5 Q9UNA0 1/20 0.30
AR P10275 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
SCHEMBL26307735 0.89 MAPT (0.33) ROCK2ADAMTS5
SCHEMBL24253592 0.89 CYP11B2 (0.33) CYP11B2ADAMTS5
SCHEMBL30423977 0.86 TSHR (0.39) BPTFTSHRHTR1ADRD2ADRA1D
SCHEMBL24253711 0.86 TSHR (0.39) BPTFTSHRHTR1ADRD2ADRA1D
Hydrochloric Acid SCHEMBL30494641 0.85 TSHR (0.38) BPTFTSHRHTR1ADRD2ADRA1D
SCHEMBL24253710 0.78 HTR1A (0.36) BPTFTSHRHTR1ADRD2ADRA1D
Hydrochloric Acid SCHEMBL30494599 0.77 HTR1A (0.36) BPTFTSHRHTR1ADRD2ADRA1D
SCHEMBL24253590 0.76 MMP2 (0.33) CYP11B2MMP13ADAMTS5
SCHEMBL26307736 0.76 CCR1 (0.33) TSHRROCK2ADAMTS5
SCHEMBL24253768 0.76 HSD11B1 (0.34) BPTFTSHRROCK2RAF1BRAF

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 2 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-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 BPTF 3108/4885TSHR 904/4885HTR1A 1336/4885
US-20220048909-A1 HETEROARYL SUBSTITUTED SPIROPIPERIDINYL DERIVATIVES AND PHARMACEUTICAL USES THEREOF REN, NR3C2, PKD1 BPTF 3108/4885TSHR 904/4885HTR1A 1336/4885

“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.