SCHEMBL16286147

SCHEMBL16286147

CN1CCN(c2ccc(Nc3ccc4cc(-c5ccccc5)c(=O)n(Cc5ccccc5C(F)(F)F)c4c3)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.50
FYN P06241 3/20 0.43
SRC P12931 2/20 0.42
LYN P07948 1/20 0.42
C5AR1 P21730 1/20 0.41
PTK2 Q05397 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
EPHX2 P34913 1/20 0.41
CDK4 P11802 2/20 0.40
CCND1 P24385 1/20 0.40
MAP4K1 Q92918 1/20 0.40
PIM1 P11309 1/20 0.39
CCND3 P30281 1/20 0.39
GSK3B P49841 1/20 0.39
FGFR1 P11362 1/20 0.39
WEE1 P30291 1/20 0.39
ADRA2A P08913 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
SCHEMBL16286148 0.90 PTK2 (0.42) BTKSRCLYNC5AR1PTK2
SCHEMBL16285680 0.88 BTK (0.55) BTKFYNSRCLYNCDK4
SCHEMBL16286126 0.86 CDK4 (0.44) BTKFYNSRCC5AR1PTK2
SCHEMBL10192791 0.83 WEE1 (0.58) BTKSRCPTK2CDK4CCND1
SCHEMBL16286134 0.80 PTK2 (0.46) FYNPTK2CYP3A4CYP2D6CYP2C9
SCHEMBL16285685 0.80 FYN (0.47) BTKFYNCDK4CCND1MAP4K1
SCHEMBL16285686 0.79 LYN (0.46) BTKFYNSRCLYNCDK4
SCHEMBL16286149 0.77 IDH2 (0.38) PTK2KIF11
SCHEMBL16286112 0.76 PTK2 (0.45) C5AR1PTK2CDK4CCND1CCND3
SCHEMBL13553894 0.75 WEE1 (0.53) FYNSRCPTK2CDK4CCND1

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-20140364430-A1 METHODS FOR TREATING SCHIZOPHRENIA AFRAXIS HOLDINGS INC (US) 2014-12-11 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-20140364430-A1 METHODS FOR TREATING SCHIZOPHRENIA GRIN2A, GRIN2C, GRIN3A BTK 3871/4885FYN 648/4885SRC 966/4885

“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.