SCHEMBL3852977

SCHEMBL3852977

O=C(Oc1ccccc1)[C](Cl)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.51
ALDH1A1 P00352 1/20 0.46
PARP10 Q53GL7 1/20 0.43
NSD2 O96028 1/20 0.43
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
F2 P00734 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SRD5A2 P31213 1/20 0.41
AKR1C3 P42330 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41

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
SCHEMBL6313194 0.80 TDP1 (0.47) ELANEALDH1A1NSD2ATMTDP1
Diphenyl Ethanedioat SCHEMBL43364 0.79 TDP1 (0.54) ELANEALDH1A1NSD2ATMTDP1
SCHEMBL2721319 0.78 CES2 (0.56) ELANEALDH1A1PARP10NSD2ATM
Diphenyl Ethanedioat SCHEMBL27328178 0.77 TDP1 (0.52) ELANEALDH1A1NSD2ATMTDP1
SCHEMBL27575859 0.77 TDP1 (0.44) ELANEALDH1A1NSD2ATMTDP1
SCHEMBL27541467 0.77 TDP1 (0.44) ELANEALDH1A1NSD2ATMTDP1
SCHEMBL4211366 0.77 ELANE (0.49) ELANEALDH1A1NSD2ATMTDP1
Benzophenone SCHEMBL16721022 0.76 ELANE (0.67) ELANEALDH1A1ATMTDP1L3MBTL1
SCHEMBL6555391 0.75 TDP1 (0.42) ELANEALDH1A1NSD2ATMTDP1
SCHEMBL39276 0.75 TDP1 (0.57) ELANEALDH1A1PARP10NSD2ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9809822-B2 Triptolide derivatives and preparation method and use thereof HONG KONG BAPTIST UNIVERSITY (HK) 2017-11-07 US claimed
US-20160362691-A1 TRIPTOLIDE DERIVATIVES AND PREPARATION METHOD AND USE THEREOF HONG KONG BAPTIST UNIVERSITY (HK) 2016-12-15 US claimed
US-9809822-B2 Triptolide derivatives and preparation method and use thereof HONG KONG BAPTIST UNIVERSITY (HK) 2017-11-07 US disclosed
US-20160362691-A1 TRIPTOLIDE DERIVATIVES AND PREPARATION METHOD AND USE THEREOF HONG KONG BAPTIST UNIVERSITY (HK) 2016-12-15 US disclosed
EP-1730228-B1 NANO-COMPOSITE AND METHOD THEREOF BRIDGESTONE CORP (JP) 2012-08-15 EP disclosed
US-7579398-B2 Nano-composite and compositions therefrom BRIDGESTONE CORPORATION (JP) 2009-08-25 US disclosed
US-7572855-B2 Nano-composite and compositions manufactured thereof BRIDGESTONE CORPORATION (JP) 2009-08-11 US disclosed
US-20090182087-A1 NANO-COMPOSITE AND COMPOSITIONS THEREFROM BRIDGESTONE CORPORATION (JP) 2009-07-16 US disclosed
EP-1730228-A1 NANO-COMPOSITE AND METHOD THEREOF Bridgestone Corporation (JP) 2006-12-13 EP disclosed
US-20060173115-A1 Nano-composite and compositions manufactured thereof BRIDGESTONE CORPORATION (JP) 2006-08-03 US disclosed
WO-2005095506-A1 NANO-COMPOSITE AND METHOD THEREOF BRIDGESTONE CORPORATION (JP) 2005-10-13 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-20160362691-A1 TRIPTOLIDE DERIVATIVES AND PREPARATION METHOD AND USE THEREOF TPD52L2, TRDMT1, MCTS1 ELANE 3819/4885ALDH1A1 2399/4885PARP10 507/4885

“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.