SCHEMBL20154604

SCHEMBL20154604

COc1ccc(NC(=O)N2C3CC2CN(C(C)C)C3)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ELOVL6 Q9H5J4 2/20 0.53
MAPT P10636 1/20 0.52
GRIN2B Q13224 3/20 0.51
SMN1; SMN2 Q16637 4/20 0.50
PAX8 Q06710 1/20 0.50
BLM P54132 1/20 0.47
TAS1R3 Q7RTX0 1/20 0.47
TAS1R1 Q7RTX1 1/20 0.47
TAS1R2 Q8TE23 1/20 0.47
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL20160526 0.88 ELOVL6 (0.49) ELOVL6MAPTGRIN2BSMN1; SMN2PAX8
SCHEMBL20153135 0.85 MAPT (0.56) ELOVL6MAPTGRIN2BSMN1; SMN2PAX8
SCHEMBL23126197 0.84 MAPT (0.55) ELOVL6MAPTGRIN2BSMN1; SMN2PAX8
SCHEMBL23555221 0.84 ALDH1A1 (0.52) ELOVL6GRIN2BSMN1; SMN2RAB9ANPC1
SCHEMBL20069825 0.82 KDM4E (0.48) MAPTSMN1; SMN2RAB9ANPC1KMT2A
SCHEMBL21158715 0.82 ELOVL6 (0.53) ELOVL6MAPTGRIN2BSMN1; SMN2PAX8
SCHEMBL23126196 0.74 ALDH1A1 (0.50) ELOVL6GRIN2BSMN1; SMN2RAB9ANPC1
SCHEMBL1574353 0.73 MAPT (0.61) MAPTGRIN2BSMN1; SMN2PAX8BLM
SCHEMBL16178389 0.73 MAPT (0.61) ELOVL6MAPTGRIN2BSMN1; SMN2PAX8
SCHEMBL22030762 0.72 RET (0.47) MAPTSMN1; SMN2RAB9ANPC1KMT2A

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 ELOVL6 4837/4885MAPT 1769/4885GRIN2B 996/4885
US-20180133213-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF ELOVL6 4837/4885MAPT 1769/4885GRIN2B 996/4885

“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.