SCHEMBL5598185

SCHEMBL5598185

CC1(O)Cc2cccc(-c3ccc(C(C)(C)C)cc3)c2C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 2/20 0.37
BRD4 O60885 1/20 0.37
TRPV1 Q8NER1 1/20 0.34
PARP1 P09874 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
HSD11B1 P28845 2/20 0.33
PTAFR P25105 1/20 0.33
WRN Q14191 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
NR2F2 P24468 1/20 0.32
LMNA P02545 2/20 0.32
TP53 P04637 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KIF11 P52732 2/20 0.32
TYR P14679 1/20 0.32
S1PR1 P21453 1/20 0.31
DGAT1 O75907 1/20 0.31

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
SCHEMBL5598859 0.82 BRD4 (0.35) CREBBPBRD4PARP1NR1H4PTAFR
SCHEMBL27519275 0.81 PRCP (0.41) KMT2AKDM4E
SCHEMBL27482270 0.81 PRCP (0.41) KMT2AKDM4E
SCHEMBL6523433 0.72 NR1H4 (0.33) CREBBPBRD4PARP1NR1H4PTAFR
SCHEMBL27816247 0.72 PNMT (0.44) CREBBPBRD4PARP1PTAFRNPC1
SCHEMBL29612355 0.71 BRD4 (0.45) CREBBPBRD4PARP1
SCHEMBL27500822 0.69 HTR7 (0.44) BRD4LMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL28930335 0.67 ALDH1A1 (0.41) HSD11B1NPC1RAB9AKMT2AMEN1
SCHEMBL5917138 0.67 CD44 (0.38) KMT2AMEN1LMNAKDM4EALDH1A1
SCHEMBL24522126 0.66 TSHR (0.48) CREBBPBRD4NR1H4NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7199274-B2 Preparation of substituted indenes BASELL POLYOLEFINE GMBH (DE) 2007-04-03 US disclosed
US-20050256344-A1 Preparation of substituted indenes BASELL POLYOLEFINE GMBH (DE) 2005-11-17 US disclosed
EP-1554233-A1 PREPARATION OF SUBSTITUTED INDENES Basell Polyolefine GmbH (DE) 2005-07-20 EP disclosed
WO-2004037756-A1 PREPARATION OF SUBSTITUTED INDENES BASELL POLYOLEFINE GMBH (DE) 2004-05-06 WO 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-20050256344-A1 Preparation of substituted indenes CYP1A2, CYP1B1, DHPS CREBBP 3239/4885BRD4 2293/4885TRPV1 4317/4885

“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.