SCHEMBL24253933

SCHEMBL24253933

NC1(C(F)(F)F)CCN(c2ccnc(N3CCC4(CCCC(=O)N4c4ccc(F)c(F)c4)CC3)n2)CC1

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 2/20 0.32
HCRTR2 O43614 2/20 0.32
KCNH2 Q12809 1/20 0.32
LTC4S Q16873 1/20 0.32
GBA1 P04062 1/20 0.32
HTR1A P08908 1/20 0.30
DRD2 P14416 1/20 0.30
ADRA1D P25100 1/20 0.30
ADRA1A P35348 1/20 0.30
ADRA1B P35368 1/20 0.30
RXRA P19793 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2B Q13224 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
SCHEMBL30423566 1.00 HCRTR1 (0.32) HCRTR1HCRTR2KCNH2LTC4SGBA1
SCHEMBL30424094 0.81 AOC3 (0.33) HCRTR1HCRTR2KCNH2LTC4S
SCHEMBL30423960 0.81 HCRTR1 (0.33) HCRTR1HCRTR2KCNH2LTC4S
SCHEMBL24253828 0.81 HCRTR1 (0.33) HCRTR1HCRTR2KCNH2LTC4S
SCHEMBL24253827 0.81 AOC3 (0.33) HCRTR1HCRTR2KCNH2LTC4S
SCHEMBL24253808 0.79 DPP4 (0.32) HTR1ADRD2ADRA1DADRA1AADRA1B
SCHEMBL30423990 0.78 CYP11B2 (0.35) HCRTR1HCRTR2KCNH2LTC4SGBA1
SCHEMBL24253632 0.77 KCNH2 (0.34) HCRTR1HCRTR2KCNH2LTC4SHTR1A
SCHEMBL24253712 0.77 KMT2A (0.41) HCRTR1HCRTR2
SCHEMBL30423539 0.77 KMT2A (0.41) HCRTR1HCRTR2

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 HCRTR1 2245/4885HCRTR2 3027/4885KCNH2 282/4885
US-20220048909-A1 HETEROARYL SUBSTITUTED SPIROPIPERIDINYL DERIVATIVES AND PHARMACEUTICAL USES THEREOF REN, NR3C2, PKD1 HCRTR1 2245/4885HCRTR2 3027/4885KCNH2 282/4885

“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.