SCHEMBL3638907

SCHEMBL3638907

CCCCCC(=O)Oc1cccc(O)c1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.56
KMT2A Q03164 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPK1 P28482 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
POLM Q9NP87 1/20 0.46
POLK Q9UBT6 1/20 0.46
POLL Q9UGP5 1/20 0.46
POLH Q9Y253 1/20 0.46
ALOX15 P16050 1/20 0.46
CA2 P00918 1/20 0.45
HTT P42858 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
SCHEMBL32684489 0.98 KMT2A (0.56) CYP3A4KMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL9538006 0.98 KMT2A (0.56) CYP3A4KMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL9716546 0.98 KMT2A (0.56) CYP3A4KMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL6139167 0.98 KMT2A (0.56) CYP3A4KMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL4079668 0.95 CYP3A4 (0.57) CYP3A4KMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL689823 0.92 CYP3A4 (0.59) CYP3A4KMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL16974801 0.91 POLM (0.54) KMT2ASMN1; SMN2MEN1ALDH1A1MAPK1
SCHEMBL16974800 0.91 POLM (0.54) KMT2ASMN1; SMN2MEN1ALDH1A1MAPK1
SCHEMBL10407331 0.90 KMT2A (0.60) KMT2ASMN1; SMN2MEN1ALDH1A1MAPK1
SCHEMBL688275 0.90 CYP3A4 (0.58) CYP3A4KMT2ASMN1; SMN2MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0687249-A1 BALANOIDS ELI LILLY AND COMPANY (US) 1995-12-20 EP claimed
WO-1994020062-A2 BALANOIDS AS PROTEIN KINASE C INHIBITORS ELI LILLY AND COMPANY (US) 1994-09-15 WO claimed
CN-108265007-A The application of deep-sea fungi 3A00421 and its fermented cpds 国家海洋局第三海洋研究所 2018-07-10 CN disclosed
EP-2152685-B1 SKIN LIGHTENING COMPOSITIONS AND METHODS SYTHEON LTD (US) 2017-01-25 EP disclosed
EP-2152685-A1 SKIN LIGHTENING COMPOSITIONS AND METHODS Sytheon Ltd. (US) 2010-02-17 EP disclosed
WO-2008153629-A1 SKIN LIGHTENING COMPOSITIONS AND METHODS SYTHEON LTD. (US) 2008-12-18 WO disclosed
US-20080305059-A1 Skin lightening compositions and methods SYTHEON LIMITED 2008-12-11 US disclosed
US-20060129002-A1 Process for the synthesis of alkylresorcinols HONEYWELL INTERNATIONAL INC. 2006-06-15 US disclosed
EP-0687249-A1 BALANOIDS ELI LILLY AND COMPANY (US) 1995-12-20 EP disclosed
WO-1994020062-A2 BALANOIDS AS PROTEIN KINASE C INHIBITORS ELI LILLY AND COMPANY (US) 1994-09-15 WO disclosed
EP-0341664-B1 SKIN DEPIGMENTAL AGENT KURARAY CO., LTD. (JP) 1992-08-05 EP disclosed
US-4959393-A ALKYL-SUBSTITUTED RESORCINOL KURARAY COMPANY, LTD. (JP) 1990-09-25 US disclosed
EP-0341664-A1 Skin depigmental agent KURARAY CO., LTD. (JP) 1989-11-15 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-20060129002-A1 Process for the synthesis of alkylresorcinols ACSL4, ZDHHC20, ACSL6 CYP3A4 264/4885KMT2A 483/4885SMN1; SMN2 4373/4885

“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.