SCHEMBL1900625

SCHEMBL1900625

CC(C)(C)c1cc(Cl)ccc1OCCCCC(=O)O

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.67
ALDH1A1 P00352 5/20 0.67
LMNA P02545 4/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
MAPK1 P28482 3/20 0.64
GAA P10253 2/20 0.64
TDP1 Q9NUW8 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
RBP4 P02753 2/20 0.57
HTT P42858 1/20 0.56
RAB9A P51151 2/20 0.52
PTGDR2 Q9Y5Y4 1/20 0.50
MAPT P10636 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
NPC1 O15118 1/20 0.49
HPGD P15428 1/20 0.49

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
SCHEMBL1901227 0.99 KDM4E (0.65) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL1895339 0.96 KDM4E (0.68) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL12409162 0.86 MAPT (0.65) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL30539409 0.84 KDM4E (0.53) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL31705260 0.83 TSHR (0.58) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL10381793 0.82 RAB9A (0.72) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL5074470 0.81 KDM4E (0.66) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL10381113 0.81 RAB9A (0.70) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL10382178 0.81 RAB9A (0.70) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL2173700 0.80 KDM4E (0.56) KDM4EALDH1A1LMNASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7973079-B2 Methods and compounds for treating retinol-related diseases REVISION THERAPEUTICS, INC. (US) 2011-07-05 US claimed
EP-2205234-A2 METHODS AND COMPOUNDS FOR TREATING RETINOL-RELATED DISEASES Sirion Therapeutics, Inc. (US) 2010-07-14 EP claimed
US-20090088435-A1 METHODS AND COMPOUNDS FOR TREATING RETINOL-RELATED DISEASES SIRION THERAPEUTICS, INC. (US) 2009-04-02 US claimed
WO-2009042444-A2 METHODS AND COMPOUNDS FOR TREATING RETINOL-RELATED DISEASES SIRION THERAPEUTICS, INC. (US) 2009-04-02 WO claimed
US-20130012591-A1 PROPHYLAXIS OF SKIN CANCER WITH RETINAMIDES REVISION THERAPEUTICS, INC. (US) 2013-01-10 US disclosed
EP-2521541-A2 PROPHYLAXIS OF SKIN CANCER WITH RETINAMIDES ReVision Therapeutics, Inc. (US) 2012-11-14 EP disclosed
US-7973079-B2 Methods and compounds for treating retinol-related diseases REVISION THERAPEUTICS, INC. (US) 2011-07-05 US disclosed
US-7973079-B2 Methods and compounds for treating retinol-related diseases REVISION THERAPEUTICS, INC. (US) 2011-07-05 US disclosed
US-7973079-B2 Methods and compounds for treating retinol-related diseases REVISION THERAPEUTICS, INC. (US) 2011-07-05 US disclosed
WO-2011059776-A2 PROPHYLAXIS OF SKIN CANCER WITH RETINAMIDES REVISION THERAPEUTICS, INC (US) 2011-05-19 WO disclosed
EP-2205234-A2 METHODS AND COMPOUNDS FOR TREATING RETINOL-RELATED DISEASES Sirion Therapeutics, Inc. (US) 2010-07-14 EP disclosed
US-20090088435-A1 METHODS AND COMPOUNDS FOR TREATING RETINOL-RELATED DISEASES SIRION THERAPEUTICS, INC. (US) 2009-04-02 US disclosed
US-20090088435-A1 METHODS AND COMPOUNDS FOR TREATING RETINOL-RELATED DISEASES SIRION THERAPEUTICS, INC. (US) 2009-04-02 US disclosed
US-20090088435-A1 METHODS AND COMPOUNDS FOR TREATING RETINOL-RELATED DISEASES SIRION THERAPEUTICS, INC. (US) 2009-04-02 US disclosed
WO-2009042444-A2 METHODS AND COMPOUNDS FOR TREATING RETINOL-RELATED DISEASES SIRION THERAPEUTICS, INC. (US) 2009-04-02 WO disclosed
WO-2009042444-A2 METHODS AND COMPOUNDS FOR TREATING RETINOL-RELATED DISEASES SIRION THERAPEUTICS, INC. (US) 2009-04-02 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-20130012591-A1 PROPHYLAXIS OF SKIN CANCER WITH RETINAMIDES ALDH1A2, ALDH1A3, CRABP2 KDM4E 462/4885ALDH1A1 60/4885LMNA 1930/4885
US-20090088435-A1 METHODS AND COMPOUNDS FOR TREATING RETINOL-RELATED DISEASES RBP1, RBP4, ALDH1A2 KDM4E 4096/4885ALDH1A1 40/4885LMNA 333/4885

“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.