SCHEMBL6360864

SCHEMBL6360864

COc1ccc2ccc3c4cc5c(cc4nnc3c2c1)OCO5

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.44
▸ LMNA P02545 4/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ HTT P42858 3/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ HPGD P15428 3/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ NPSR1 Q6W5P4 2/20 0.42
▸ PKM P14618 2/20 0.42
▸ ADORA2A P29274 1/20 0.42
▸ ADORA1 P30542 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ CASP3 P42574 1/20 0.40
▸ SENP7 Q9BQF6 1/20 0.40
▸ CTSL P07711 1/20 0.40
▸ CTSB P07858 1/20 0.40
▸ TDP1 Q9NUW8 6/20 0.40
▸ PDE5A O76074 1/20 0.39

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
SCHEMBL6361067 0.92 MAPT (0.44) MAPTLMNAALDH1A1SMN1; SMN2HTT
SCHEMBL6361049 0.85 TDP1 (0.53) MAPTLMNAALDH1A1SMN1; SMN2HPGD
SCHEMBL26843498 0.82 TDP1 (0.46) MAPTLMNAALDH1A1SMN1; SMN2KDM4E
SCHEMBL7483591 0.78 ALDH1A1 (0.48) MAPTLMNAALDH1A1SMN1; SMN2HTT
SCHEMBL5007542 0.77 CASP3 (0.50) MAPTLMNAALDH1A1SMN1; SMN2HTT
SCHEMBL6360532 0.73 RAD52 (0.46) MAPTLMNAALDH1A1SMN1; SMN2KDM4E
SCHEMBL6360527 0.71 RAD52 (0.47) MAPTLMNAALDH1A1SMN1; SMN2HTT
SCHEMBL7483599 0.69 MPO (0.38) MAPTLMNAALDH1A1SMN1; SMN2HTT
SCHEMBL6361695 0.67 NQO2 (0.42) MAPTALDH1A1KDM4ETDP1
SCHEMBL746722 0.67 ALDH1A1 (0.56) MAPTLMNAALDH1A1SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050009830-A1 Heterocyclic cytotoxic agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY. 2005-01-13 — — US claimed
US-6740650-B2 SUCH AS 2,3-DIMETHOXY-DIBENZO(C,H)CINNOLINE FOR TREATMENT OF CANCER; FUNGICIDES RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2004-05-25 — — US claimed
US-20030100560-A1 Heterocyclic cytotoxic agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2003-05-29 — — US claimed
EP-1228045-A2 HETEROCYCLIC CYTOTOXIC AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2002-08-07 — — EP claimed
WO-2001032631-A2 HETEROCYCLIC CYTOTOXIC AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JEREY (US) 2001-05-10 — — WO claimed
US-20050009830-A1 Heterocyclic cytotoxic agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY. 2005-01-13 — — US disclosed
US-6740650-B2 SUCH AS 2,3-DIMETHOXY-DIBENZO(C,H)CINNOLINE FOR TREATMENT OF CANCER; FUNGICIDES RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2004-05-25 — — US disclosed
US-20030100560-A1 Heterocyclic cytotoxic agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2003-05-29 — — 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 (2 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-20050009830-A1 Heterocyclic cytotoxic agents CCNE1, RB1, CCNA1 MAPT 4872/4885LMNA 1515/4885ALDH1A1 345/4885
US-20030100560-A1 Heterocyclic cytotoxic agents CCNA1, CCNE1, MCL1 MAPT 4835/4885LMNA 1211/4885ALDH1A1 114/4885

“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.

Send feedback