SCHEMBL22857089

SCHEMBL22857089

CC(S)N1CCC(C)(C(=O)Nc2ccccc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.49
CETP P11597 2/20 0.45
ALDH1A1 P00352 5/20 0.42
TSHR P16473 2/20 0.40
CYP2C19 P33261 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
LMNA P02545 3/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NPY2R P49146 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
FAAH O00519 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL20147938 0.89 ALDH1A1 (0.53) DRD2CETPALDH1A1TSHRCYP2C19
SCHEMBL20069153 0.81 DRD2 (0.54) DRD2CETPALDH1A1TSHRCYP2C19
SCHEMBL20205744 0.80 OPRM1 (0.44) CETPALDH1A1NPY2RKMT2AATM
SCHEMBL1522066 0.80 NAPRT (0.52) DRD2CETPALDH1A1TSHRCYP2C19
SCHEMBL21651967 0.77 DRD2 (0.60) DRD2TSHRCYP2C19CYP1A2CYP2C9
SCHEMBL20205761 0.77 KMT2A (0.46) ALDH1A1LMNAHTTNPSR1MEN1
SCHEMBL20328008 0.74 CYP1A2 (0.34) CETPALDH1A1CYP2C19CYP1A2CYP2C9
SCHEMBL22857073 0.74 ALDH1A1 (0.50) DRD2CETPALDH1A1TSHRCYP2C19
SCHEMBL21652031 0.74 POLB (0.50) ALDH1A1TSHRHTTNPSR1POLB
SCHEMBL20158643 0.73 MAPT (0.60) ALDH1A1MEN1KMT2AFAAHGAA

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 DRD2 3425/4885CETP 4877/4885ALDH1A1 2547/4885

“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.