SCHEMBL6770094

SCHEMBL6770094

C[Si](C)(C)CNCCc1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.57
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA4 P22748 1/20 0.45
CA9 Q16790 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
CHRM2 P08172 2/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
IDO1 P14902 1/20 0.44
LMNA P02545 2/20 0.43
BCHE P06276 1/20 0.42
GAA P10253 1/20 0.41
CNR1 P21554 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
AOC3 Q16853 1/20 0.40

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
SCHEMBL5681339 0.81 TAAR1 (0.67) TAAR1CA12CA1CA2CA4
SCHEMBL7104726 0.80 SIGMAR1 (0.55) TAAR1CYP1A2CYP2D6CYP2C19IDO1
SCHEMBL13589443 0.78 TAAR1 (0.63) TAAR1CA12CA1CA2CA4
SCHEMBL23374691 0.76 TAAR1 (0.61) TAAR1CA12CA1CA2CA4
Hydrochloric Acid SCHEMBL4392199 0.76 TAAR1 (0.61) TAAR1CA12CA1CA2CA4
SCHEMBL3390609 0.75 CA12 (0.55) TAAR1CA12CA1CA2CA4
SCHEMBL3387165 0.75 CA12 (0.55) TAAR1CA12CA1CA2CA4
SCHEMBL12652266 0.74 TAAR1 (0.57) TAAR1CA12CA1CA2CA4
SCHEMBL938702 0.73 TAAR1 (0.57) TAAR1CA12CA1CA2CA4
SCHEMBL14389063 0.73 SMN1; SMN2 (0.62) TAAR1CA12CA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6710064-B2 FOR THERAPY OF INFLAMMATORY OR IMMUNE DISEASES BRISTOL-MYERS SQUIBB CO. 2004-03-23 US disclosed
EP-1339718-A1 HYDANTOIN COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS Bristol-Myers Squibb Company (US) 2003-09-03 EP disclosed
US-20020143035-A1 Hydantoin compounds useful as anti-inflammatory agents BRISTOL-MYERS SQUIBB COMPANY 2002-10-03 US disclosed
WO-2002044181-A1 HYDANTOIN COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-06-06 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-20020143035-A1 Hydantoin compounds useful as anti-inflammatory agents HRH4, IL4I1, HRH2 TAAR1 3099/4885CA12 2932/4885CA1 1469/4885

“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.