SCHEMBL14415973

SCHEMBL14415973

CC(C)Cn1cncc1CCN

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 11/20 0.33
CYP11B2 P19099 11/20 0.33
POLB P06746 2/20 0.33
KCNH2 Q12809 2/20 0.32
DYRK1A Q13627 1/20 0.32
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
MTOR P42345 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
TOP2A P11388 1/20 0.30
LMNA P02545 1/20 0.30
HRH2 P25021 1/20 0.30
ADRA1D P25100 1/20 0.30
HTR2A P28223 1/20 0.30
ADORA2A P29274 1/20 0.30
ADRA1A P35348 1/20 0.30
NUDT1 P36639 1/20 0.30
HTR2B P41595 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
Hydrochloric Acid SCHEMBL31735658 0.84 POLB (0.34) POLBKCNH2DYRK1ATOP2ALMNA
SCHEMBL13253965 0.79 POLB (0.36) POLBKCNH2DYRK1ATOP2A
SCHEMBL1785054 0.79 KCNH2 (0.40) CYP11B1CYP11B2KCNH2CYP2C9TSHR
SCHEMBL12056290 0.79 IDO1 (0.35) CYP11B1CYP11B2POLBKCNH2DYRK1A
SCHEMBL13059068 0.78 POLB (0.35) CYP11B1CYP11B2POLBKCNH2DYRK1A
SCHEMBL5654439 0.78 CYP11B1 (0.44) CYP11B1CYP11B2POLBKCNH2DYRK1A
Hydrochloric Acid SCHEMBL860676 0.76 POLB (0.34) CYP11B1CYP11B2POLBKCNH2DYRK1A
SCHEMBL14465623 0.76 CYP2C9 (0.35) CYP11B1CYP11B2CYP2C9TSHRCYP2C19
SCHEMBL15613574 0.75 CYP11B1 (0.36) CYP11B1CYP11B2POLBKCNH2DYRK1A
SCHEMBL14465621 0.74 HRH4 (0.35) CYP11B1CYP11B2CYP2C9TSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070213340-A1 Farnesyl protein transferase inhibitors SCHERING CORPORATION 2007-09-13 US disclosed
US-20070213340-A1 Farnesyl protein transferase inhibitors SCHERING CORPORATION 2007-09-13 US disclosed
WO-2007084498-A1 PIPERAZINE DERIVATIVES AS FARNESYL PROTEIN TRANSFERASE INHIBITORS SCHERING CORPORATION (US) 2007-07-26 WO 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-20070213340-A1 Farnesyl protein transferase inhibitors FNTB, FNTA, FDPS CYP11B1 1991/4885CYP11B2 2663/4885POLB 4387/4885

“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.