SCHEMBL10028899

SCHEMBL10028899

CCn1cc(C(C)=O)c(=O)c2cc(F)c(N3CCN(CC(P(=O)(O)O)P(=O)(O)O)CC3)nc21

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.58
CYP2C9 P11712 1/20 0.58
ATP6V1B2 P21281 1/20 0.58
TBXA2R P21731 1/20 0.58
EDNRA P25101 1/20 0.58
TARBP2 Q15633 1/20 0.58
GAA P10253 3/20 0.41
RAD52 P43351 1/20 0.41
KDM4E B2RXH2 6/20 0.40
KMT2A Q03164 7/20 0.40
MEN1 O00255 6/20 0.40
ALDH1A1 P00352 4/20 0.40
DRD3 P35462 1/20 0.39
GLA P06280 1/20 0.39
TSHR P16473 1/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
CASP1 P29466 1/20 0.38
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL659309 0.93 LMNA (0.69) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL16518625 0.82 LMNA (0.85) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL8044673 0.81 LMNA (0.79) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL23197066 0.77 LMNA (0.65) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL4904141 0.77 LMNA (0.79) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL11153426 0.76 LMNA (0.82) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL12665451 0.76 LMNA (0.75) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL21074731 0.76 LMNA (0.57) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL10028900 0.76 LMNA (0.81) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL11013455 0.74 LMNA (0.69) LMNACYP2C9ATP6V1B2TBXA2REDNRA

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-20120046246-A1 METHODS FOR TREATING OSTEOCLAST-RELATED DISEASE, COMPOUNDS AND COMPOSITIONS THEREOF UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2012-02-23 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-20120046246-A1 METHODS FOR TREATING OSTEOCLAST-RELATED DISEASE, COMPOUNDS AND COMPOSITIONS THEREOF CTSB, SOST, CTSG LMNA 1220/4885CYP2C9 4801/4885ATP6V1B2 3689/4885

“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.