SCHEMBL2173700

SCHEMBL2173700

CC(C)(C)c1cc(Cl)ccc1OCCCCC(=O)Nc1ccc(C(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.56
ALDH1A1 P00352 6/20 0.56
LMNA P02545 6/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
TDP1 Q9NUW8 2/20 0.53
NPSR1 Q6W5P4 1/20 0.53
POLB P06746 3/20 0.52
MAPK1 P28482 3/20 0.52
GAA P10253 2/20 0.52
HPGD P15428 3/20 0.50
MAPT P10636 2/20 0.48
HTT P42858 1/20 0.48
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL1899477 0.91 KDM4E (0.53) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL2174789 0.91 KDM4E (0.53) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL1899907 0.89 KDM4E (0.56) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL1897740 0.88 CNR1 (0.56) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL12409169 0.87 KDM4E (0.54) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL1898361 0.86 RBP4 (0.45) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL2173939 0.81 KDM4E (0.61) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL1900625 0.80 KDM4E (0.67) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL1901227 0.79 KDM4E (0.65) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL12409162 0.78 MAPT (0.65) 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 12 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
US-20090088435-A1 METHODS AND COMPOUNDS FOR TREATING RETINOL-RELATED DISEASES SIRION THERAPEUTICS, INC. (US) 2009-04-02 US claimed
US-20130012591-A1 PROPHYLAXIS OF SKIN CANCER WITH RETINAMIDES REVISION THERAPEUTICS, INC. (US) 2013-01-10 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
US-7973079-B2 Methods and compounds for treating retinol-related diseases REVISION THERAPEUTICS, INC. (US) 2011-07-05 US 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.