SCHEMBL25097635

SCHEMBL25097635

CC(C)(C)[Si](C)(C)OCc1ccc2[nH]nc(I)c2c1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.33
CNR1 P21554 3/20 0.33
MAP2K4 P45985 1/20 0.32
USP14 P54578 1/20 0.32
NTRK1 P04629 3/20 0.31
LMNA P02545 1/20 0.30
RAB9A P51151 1/20 0.30
MAPK10 P53779 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL5582864 0.85 JAK2 (0.43) NTRK1
SCHEMBL25097632 0.81 NTRK1 (0.40) CNR2CNR1MAP2K4USP14NTRK1
SCHEMBL16534159 0.78 KDM4E (0.50) NTRK1LMNARAB9AMAPK10SMN1; SMN2
SCHEMBL298834 0.76 CA12 (0.40) HSD17B10
SCHEMBL2660555 0.76 NTRK1 (0.44) NTRK1SMN1; SMN2
SCHEMBL14755242 0.74 MAP2K4 (0.35) MAP2K4NTRK1
SCHEMBL25097633 0.72 NOS1 (0.45) RAB9A
SCHEMBL14737842 0.72 CNR2 (0.36) CNR2CNR1USP14
SCHEMBL13375276 0.71 MAP2K4 (0.49) MAP2K4NTRK1
SCHEMBL1623188 0.71

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-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2023-03-09 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-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH CNR2 1208/4885CNR1 1311/4885MAP2K4 1732/4885

“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.