SCHEMBL5848239

SCHEMBL5848239

CC(=O)c1ccc2c(c1)C1(c3cc(C(C)=O)ccc3-2)c2cc(C(C)=O)ccc2-c2ccc(C(C)=O)cc21

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.59
RAB9A P51151 2/20 0.59
NPC1 O15118 1/20 0.59
PDK2 Q15119 1/20 0.56
HSD17B1 P14061 3/20 0.50
S100A4 P26447 1/20 0.48
KMT2A Q03164 2/20 0.42
CYP2A6 P11509 1/20 0.42
PKM P14618 1/20 0.41
HPGD P15428 3/20 0.40
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PRKCI P41743 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PGR P06401 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP2 O95551 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
SCHEMBL6861448 1.00 MAPT (0.59) MAPTRAB9ANPC1PDK2HSD17B1
SCHEMBL5847799 0.91 PDK2 (0.65) MAPTRAB9ANPC1PDK2HSD17B1
SCHEMBL5848202 0.91 PDK2 (0.65) MAPTRAB9ANPC1PDK2HSD17B1
SCHEMBL599077 0.91 PDK2 (0.65) MAPTRAB9ANPC1PDK2HSD17B1
SCHEMBL15040997 0.85 MAPT (0.57) MAPTRAB9ANPC1PDK2HSD17B1
SCHEMBL15040998 0.85 MAPT (0.57) MAPTRAB9ANPC1PDK2HSD17B1
SCHEMBL20371195 0.83 PDK2 (0.57) MAPTRAB9ANPC1PDK2HSD17B1
SCHEMBL14691020 0.83 PDK2 (0.57) MAPTRAB9ANPC1PDK2HSD17B1
SCHEMBL16891316 0.83 PDK2 (0.57) MAPTRAB9ANPC1PDK2HSD17B1
SCHEMBL15040978 0.82 MAPT (0.53) MAPTRAB9ANPC1PDK2HSD17B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7088757-B1 Use of spiro compounds as laser dyes SEMICONDUCTORS GMBH (DE) 2006-08-08 US disclosed
US-6822094-B2 AMORPHOUS SPIROBIFLUORENE COMPOUND USED IN A PHOTOVOLTIC CELL AS CHARGE TRANSPORTING MATERIAL AVENTIS RESEARCH & TECHNOLOGIES, GMBH & CO. KG (DE) 2004-11-23 US disclosed
EP-0935691-B1 OPTICAL BRIGHTENING AGENT COVION ORGANIC SEMICONDUCTORS (DE) 2004-05-26 EP disclosed
US-20030111107-A1 Spiro compounds and their use MERCK OLED MATERIALS GMBH (DE) 2003-06-19 US disclosed
EP-0676461-B1 Spiro compounds and their application as electroluminescence materials COVION ORGANIC SEMICONDUCTORS (DE) 2002-08-14 EP disclosed
EP-1053578-B1 USE OF SPIRO COMPOUNDS AS LASER DYES COVION ORGANIC SEMICONDUCTORS (DE) 2002-05-08 EP disclosed
EP-0968175-B1 SPIRO COMPOUNDS AND THE USE THEREOF CELANESE VENTURES GMBH (DE) 2001-12-12 EP disclosed
US-6187224-B1 ORGANIC SPIRO COMPOUNDS WHICH COMPRISE A CONJUGATED SYSTEM AXIVA GMBH (DE) 2001-02-13 US disclosed
EP-0968175-A1 SPIRO COMPOUNDS AND THE USE THEREOF Aventis Research & Technologies GmbH & Co KG (DE) 2000-01-05 EP disclosed
EP-0935691-A1 OPTICAL BRIGHTENING AGENT Aventis Research & Technologies GmbH & Co. KG (DE) 1999-08-18 EP disclosed
US-5840217-A LIGHT-EMITTING, CHARGE-TRANSPORT, CHARGE-INJECTION MATERIALS HOECHST AKTIENGESELLSCHAFT (DE) 1998-11-24 US disclosed
WO-1998042655-A1 SPIRO COMPOUNDS AND THE USE THEREOF AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO KG (DE) 1998-10-01 WO disclosed
WO-1998018996-A1 OPTICAL BRIGHTENING AGENT AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO KG (DE) 1998-05-07 WO disclosed
EP-0676461-A2 Spiro compounds and their application as electroluminescence materials HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-11 EP 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-20030111107-A1 Spiro compounds and their use PKD1, PKD2, REN MAPT 3788/4885RAB9A 1156/4885NPC1 262/4885

“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.