SCHEMBL20154458

SCHEMBL20154458

CC(C)N1CC2CC(C1)N2C(=O)C1CC1CC(C)N1CC2CC(C1)N2C(=O)C1CCC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.36
CNR1 P21554 1/20 0.33
TSHR P16473 1/20 0.31
CCR2 P41597 2/20 0.30
CHRNB2 P17787 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 1/20 0.30
CHRNB3 Q05901 1/20 0.30
CHRNA6 Q15825 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
SCHEMBL20148607 0.84 RECQL (0.44) RECQLCNR1TSHRCCR2CHRNB2
SCHEMBL20148605 0.83 RECQL (0.47) RECQLCNR1TSHRCCR2CHRNB2
SCHEMBL20071310 0.81 RECQL (0.44) RECQLCNR1TSHRCCR2CHRNB2
SCHEMBL20071302 0.78 HRH3 (0.40) RECQLCNR1TSHRCCR2CHRNB2
SCHEMBL22030752 0.76 RECQL (0.44) RECQLCNR1TSHRCCR2CHRNB2
SCHEMBL20071315 0.74 PIK3CD (0.40) RECQLCNR1CCR2CHRNB2CHRNA3
SCHEMBL26203668 0.74 RECQL (0.46) RECQLCNR1TSHRCHRNB2CHRNA3
SCHEMBL20070420 0.73 PIK3CD (0.49) TSHRCCR2
SCHEMBL20148606 0.73 MAPT (0.38) RECQLCNR1TSHRCCR2CHRNB2
SCHEMBL21738123 0.72 HRH3 (0.41) RECQLCNR1

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-10172851-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-01-08 US disclosed
US-20180133213-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 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-10172851-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, ROR1, BRAF RECQL 835/4885CNR1 3884/4885TSHR 1461/4885
US-20180133213-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF RECQL 835/4885CNR1 3884/4885TSHR 1461/4885

“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.