SCHEMBL3095189

SCHEMBL3095189

O=C(O)c1ccc2cc3n(c2c1)CCNCc1cc(OCc2ccncc2)ccc1-3

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.40
MRGPRX4 Q96LA9 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
MCHR1 Q99705 1/20 0.39
RPS6KA3 P51812 4/20 0.38
RPS6KA2 Q15349 3/20 0.38
POLB P06746 2/20 0.38
TDP2 O95551 1/20 0.36
ITGB3 P05106 2/20 0.36
ITGA2B P08514 2/20 0.36
MAPKAPK2 P49137 2/20 0.35
GFER P55789 1/20 0.35
PAX8 Q06710 1/20 0.35
KLF5 Q13887 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL3079143 0.87 GPR84 (0.42) GPR84MCHR1RPS6KA3RPS6KA2
SCHEMBL3087341 0.86 CSNK2A2 (0.39) MRGPRX4RXRARXRBRPS6KA3RPS6KA2
SCHEMBL4139602 0.82 RPS6KA2 (0.38) MRGPRX4RXRARXRBRXRGMCHR1
SCHEMBL3087467 0.77 RPS6KA3 (0.39) RPS6KA3RPS6KA2MAPKAPK2
SCHEMBL3092044 0.76 RPS6KA2 (0.43) RPS6KA3RPS6KA2MAPKAPK2
SCHEMBL4146046 0.73 RPS6KA3 (0.42) MRGPRX4RXRARXRBRPS6KA3RPS6KA2
SCHEMBL3086678 0.73 RPS6KA3 (0.43) RPS6KA3RPS6KA2MAPKAPK2
SCHEMBL4143764 0.72 RPS6KA2 (0.40) RPS6KA3RPS6KA2MAPKAPK2
SCHEMBL4145557 0.70 SYK (0.43) RPS6KA3RPS6KA2
SCHEMBL4144627 0.69 RPS6KA2 (0.39) RPS6KA3RPS6KA2MAPKAPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7795247-B2 Tetracyclic indole derivatives as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2010-09-14 US disclosed
US-20060100262-A1 Tetracyclic indole derivatives as antiviral agents ISTITUTO DI RICHERCHEDI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IRMB) (IT) 2006-05-11 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-20060100262-A1 Tetracyclic indole derivatives as antiviral agents IDO1, ZC3HAV1, IDO2 GPR84 1610/4885MRGPRX4 444/4885NPC1 805/4885

“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.