SCHEMBL2839320

SCHEMBL2839320

COc1cc(C=O)ccc1OCc1ccc2ccccc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.65
SMN1; SMN2 Q16637 2/20 0.65
RAB9A P51151 4/20 0.64
MAPT P10636 5/20 0.60
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
NPC1 O15118 3/20 0.60
HTT P42858 1/20 0.60
FDPS P14324 1/20 0.58
TTR P02766 1/20 0.55
TSHR P16473 1/20 0.54
NQO2 P16083 1/20 0.54
PDCD1 Q15116 1/20 0.52
CD274 Q9NZQ7 1/20 0.52
GSK3B P49841 1/20 0.52
CYP2C9 P11712 2/20 0.51
HPGD P15428 2/20 0.51
TACR2 P21452 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51

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
SCHEMBL9597779 0.95 RAB9A (0.64) ALDH1A1SMN1; SMN2RAB9AMAPTMEN1
SCHEMBL16272295 0.85 RAB9A (0.66) ALDH1A1SMN1; SMN2RAB9AMAPTMEN1
SCHEMBL161066 0.85 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2RAB9AMAPTMEN1
SCHEMBL2699064 0.83 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2RAB9AMAPTMEN1
SCHEMBL6687620 0.83 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2RAB9AMAPTMEN1
SCHEMBL6232167 0.82 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2RAB9AMAPTMEN1
SCHEMBL10434818 0.81 APP (0.60) ALDH1A1RAB9AMAPTCYP1A2
SCHEMBL14554263 0.81 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2RAB9AMAPTMEN1
SCHEMBL6690292 0.81 L3MBTL1 (0.50) ALDH1A1SMN1; SMN2RAB9AMAPTMEN1
SCHEMBL12517074 0.81 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2RAB9AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2799427-B1 Therapeutic compounds FIBROTECH THERAPEUTICS PTY LTD (AU) 2018-07-04 EP disclosed
EP-2799427-B1 Therapeutic compounds FIBROTECH THERAPEUTICS PTY LTD (AU) 2018-07-04 EP disclosed
US-9561201-B2 Therapeutic compounds FIBROTECH THERAPEUTICS PTY LTD (AU) 2017-02-07 US disclosed
US-9561201-B2 Therapeutic compounds FIBROTECH THERAPEUTICS PTY LTD (AU) 2017-02-07 US disclosed
US-20140357628-A1 THERAPEUTIC COMPOUNDS FIBROTECH THERAPEUTICS PTY LTD (AU) 2014-12-04 US disclosed
US-20140357628-A1 THERAPEUTIC COMPOUNDS FIBROTECH THERAPEUTICS PTY LTD (AU) 2014-12-04 US disclosed
EP-2799427-A1 Therapeutic compounds Fibrotech Therapeutics PTY LTD (AU) 2014-11-05 EP disclosed
US-8765812-B2 Therapeutic compounds FIBROTECH THERAPEUTICS PTY LTD (AU) 2014-07-01 US disclosed
US-8765812-B2 Therapeutic compounds FIBROTECH THERAPEUTICS PTY LTD (AU) 2014-07-01 US disclosed
US-8765812-B2 Therapeutic compounds FIBROTECH THERAPEUTICS PTY LTD (AU) 2014-07-01 US disclosed
EP-2035369-B1 THERAPEUTIC COMPOUNDS FIBROTECH THERAPEUTICS PTY LTD (AU) 2014-06-25 EP disclosed
EP-2035369-B1 THERAPEUTIC COMPOUNDS FIBROTECH THERAPEUTICS PTY LTD (AU) 2014-06-25 EP disclosed
US-20100130497-A1 Therapeutic Compounds FIBROTECH THERAPEUTICS PTY LTD (AU) 2010-05-27 US disclosed
US-20100130497-A1 Therapeutic Compounds FIBROTECH THERAPEUTICS PTY LTD (AU) 2010-05-27 US disclosed
US-20100130497-A1 Therapeutic Compounds FIBROTECH THERAPEUTICS PTY LTD (AU) 2010-05-27 US disclosed
EP-2035369-A1 THERAPEUTIC COMPOUNDS Fibrotech Therapeutics PTY LTD (AU) 2009-03-18 EP disclosed
WO-2008003141-A1 THERAPEUTIC COMPOUNDS FIBROTECH THERAPEUTICS PTY LTD (AU) 2008-01-10 WO disclosed
WO-2008003141-A1 THERAPEUTIC COMPOUNDS FIBROTECH THERAPEUTICS PTY LTD (AU) 2008-01-10 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 (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-20140357628-A1 THERAPEUTIC COMPOUNDS NFATC1, AADAC, NAT1 ALDH1A1 201/4885SMN1; SMN2 2743/4885RAB9A 1097/4885
US-20100130497-A1 Therapeutic Compounds NFATC1, NAT1, AADAC ALDH1A1 199/4885SMN1; SMN2 2723/4885RAB9A 1186/4885

“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.