SCHEMBL3073902

SCHEMBL3073902

O=C1Cn2c(cc3ccc(C(=O)O)cc32)-c2ccccc2CN1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RPS6KA2 Q15349 10/20 0.41
RPS6KA3 P51812 6/20 0.41
SRD5A2 P31213 2/20 0.39
SRD5A1 P18405 1/20 0.39
ALDH1A1 P00352 1/20 0.37
AKR1C3 P42330 1/20 0.37
AKR1C2 P52895 1/20 0.37
AKR1C1 Q04828 1/20 0.37
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
TTR P02766 1/20 0.36
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
PTPRC P08575 2/20 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
SCHEMBL3089903 0.89 RPS6KA2 (0.44) RPS6KA2RPS6KA3SRD5A2SRD5A1
SCHEMBL3084506 0.83 KDM4E (0.44) RPS6KA2RPS6KA3ALDH1A1AKR1C3POLB
SCHEMBL3093321 0.81 RPS6KA2 (0.38) RPS6KA2RPS6KA3
SCHEMBL3092044 0.81 RPS6KA2 (0.43) RPS6KA2RPS6KA3SRD5A2SRD5A1
SCHEMBL4144549 0.80 RPS6KA2 (0.42) RPS6KA2RPS6KA3ALDH1A1AKR1C3POLB
SCHEMBL3574670 0.77 SRD5A2 (0.50) RPS6KA2RPS6KA3SRD5A2SRD5A1ALDH1A1
SCHEMBL2430933 0.76 RPS6KA2 (0.37) RPS6KA2RPS6KA3
SCHEMBL3080181 0.76 SRD5A2 (0.40) RPS6KA2RPS6KA3SRD5A2SRD5A1ALDH1A1
SCHEMBL4144545 0.75 RPS6KA2 (0.36) RPS6KA2RPS6KA3SRD5A2SRD5A1
SCHEMBL3080179 0.74 RPS6KA2 (0.54) RPS6KA2RPS6KA3

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 RPS6KA2 2765/4885RPS6KA3 1950/4885SRD5A2 406/4885

“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.