SCHEMBL5007542

SCHEMBL5007542

COc1ccc2ccc3cc4c(cc3c2c1)OCO4

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 1/20 0.50
▸ SENP7 Q9BQF6 1/20 0.50
▸ CTSL P07711 1/20 0.49
▸ CTSB P07858 1/20 0.49
▸ BCL2L1 Q07817 1/20 0.49
▸ MCL1 Q07820 1/20 0.49
▸ BAK1 Q16611 1/20 0.49
▸ ALDH1A1 P00352 5/20 0.45
▸ MAPT P10636 4/20 0.45
▸ HPGD P15428 4/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ BCHE P06276 2/20 0.45
▸ ACHE P22303 2/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ ATP2A1 O14983 1/20 0.45
▸ USP2 O75604 1/20 0.45

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
SCHEMBL10049565 0.79 ALOX5 (0.47) CASP3SENP7CTSLCTSBALDH1A1
SCHEMBL10049569 0.79 CTSL (0.44) CASP3SENP7CTSLCTSBBCL2L1
SCHEMBL20350034 0.79 CASP3 (0.42) CASP3SENP7CTSLCTSBALDH1A1
SCHEMBL20349968 0.79 ALDH1A1 (0.58) CASP3SENP7CTSLCTSBALDH1A1
SCHEMBL19382614 0.79 CYP1A2 (0.61) CASP3SENP7ALDH1A1MAPTHPGD
SCHEMBL746722 0.77 ALDH1A1 (0.56) ALDH1A1MAPTHPGDSMN1; SMN2KMT2A
SCHEMBL20350032 0.77 ALDH1A1 (0.56) CASP3SENP7CTSLCTSBALDH1A1
SCHEMBL6360864 0.77 MAPT (0.44) CASP3SENP7CTSLCTSBALDH1A1
SCHEMBL3921382 0.77 EDNRA (0.50) CTSLCTSBALDH1A1HPGDKMT2A
SCHEMBL10049566 0.76 L3MBTL1 (0.48) CTSLCTSBALDH1A1MAPTHPGD

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-8188089-B2 Tylophorine analogs as antitumor agents THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2012-05-29 — — US disclosed
US-20080300254-A1 Tylophorine Analogs as Antitumor Agents NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-12-04 — — 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-20080300254-A1 Tylophorine Analogs as Antitumor Agents RPL30, RPL18A, RPP30 CASP3 917/4885SENP7 4721/4885CTSL 1844/4885

“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