SCHEMBL22857041

SCHEMBL22857041

CN1CCC(C)(NC(=O)c2ccccc2C2CC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.42
P2RX7 Q99572 2/20 0.39
SCN1A P35498 2/20 0.39
SCN2A Q99250 2/20 0.39
SCN3A Q9NY46 2/20 0.39
SSTR4 P31391 2/20 0.38
SSTR1 P30872 1/20 0.38
CCR3 P51677 1/20 0.38
KMT2A Q03164 1/20 0.38
HTR1A P08908 3/20 0.37
HTR1F P30939 3/20 0.37
HTR1B P28222 2/20 0.37
HTR1D P28221 1/20 0.37
LMNA P02545 1/20 0.36
SMYD3 Q9H7B4 2/20 0.36
GAA P10253 1/20 0.36
HCN1 O60741 2/20 0.36
HCN4 Q9Y3Q4 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35

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
SCHEMBL20147577 0.86 RET (0.41) RETP2RX7CCR3KMT2AHCN1
SCHEMBL21652024 0.81 P2RX7 (0.57) P2RX7SCN1ASCN2ASCN3AKMT2A
SCHEMBL20068945 0.80 HCN1 (0.51) CCR3KMT2AGAAHCN1
SCHEMBL20069742 0.80 KMT2A (0.54) P2RX7KMT2AHCN1HCN4
SCHEMBL20068951 0.78 SCN1A (0.45) RETP2RX7SCN1ASCN2ASCN3A
SCHEMBL20068935 0.77 BCAT2 (0.50) RETP2RX7SCN1ASCN2ASCN3A
SCHEMBL20068936 0.77 HCN1 (0.55) HCN1HCN4
SCHEMBL20069770 0.76 LMNA (0.50) RETCCR3LMNAGAA
SCHEMBL20068937 0.76 RET (0.45) RETP2RX7SCN1ASCN2ASCN3A
SCHEMBL16565618 0.76 ATM (0.49) P2RX7SCN1ASCN2ASCN3AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2021-01-05 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 (1 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-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 RET 1/4885P2RX7 1456/4885SCN1A 1522/4885

“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.