SCHEMBL4404148

SCHEMBL4404148

CCOC(=O)c1cc2c(F)c(F)ccc2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.56
ALDH1A1 P00352 7/20 0.56
RAB9A P51151 6/20 0.56
HPGD P15428 5/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
HSD17B10 Q99714 2/20 0.56
ALOX15 P16050 1/20 0.53
NPC1 O15118 5/20 0.52
LMNA P02545 2/20 0.52
HTT P42858 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
HRH3 Q9Y5N1 1/20 0.52
MMP13 P45452 5/20 0.51
MMP2 P08253 4/20 0.51
MAPT P10636 4/20 0.51
GAA P10253 4/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
GLA P06280 1/20 0.51
ATM Q13315 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
SCHEMBL5622542 0.89 KDM4E (0.56) KDM4EALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL22620608 0.86 KDM4E (0.53) KDM4EALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL4403101 0.86 ALOX15 (0.54) KDM4EALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL1883225 0.86 ALOX15 (0.58) KDM4EALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL30193757 0.86 ALOX15 (0.58) KDM4EALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL22620607 0.86 KDM4E (0.53) KDM4EALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL22620680 0.85 KDM4E (0.51) KDM4EALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL25748437 0.85 KDM4E (0.55) KDM4EALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL22620609 0.84 KDM4E (0.51) KDM4EALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL8959852 0.84 KDM4E (0.51) KDM4EALDH1A1RAB9AHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020244462-A1 INDOLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF 中国药科大学 2020-12-10 WO disclosed
EP-1390029-B1 PHENYLINDOLES FOR THE TREATMENT OF HIV IDENIX CAYMAN LTD (KY) 2009-12-16 EP disclosed
US-20070293668-A1 Phenylindoles for the treatment of HIV LACOLLA PAULO 2007-12-20 US disclosed
EP-1390029-A4 PHENYLINDOLES FOR THE TREATMENT OF HIV IDENIX CAYMAN LTD (KY) 2005-11-30 EP disclosed
US-20040180888-A1 Phenylindoles for the treatment of HIV IDENIX PHARMACEUTICALS INC. 2004-09-16 US disclosed
US-6710068-B2 PHENYLSULFONYLINODLES USEFUL FOR THE TREATMENT OF HIV IN HUMANS AND OTHER HOST ANIMALS IDENIX PHARMACEUTICALS, INC. 2004-03-23 US disclosed
EP-1390029-A1 PHENYLINDOLES FOR THE TREATMENT OF HIV Idenix (Cayman) Limited (KY) 2004-02-25 EP disclosed
US-20020193415-A1 Phenylindoles for the treatment of HIV IDENIX PHARMACEUTICALS INC. 2002-12-19 US disclosed
WO-2002083126-A1 PHENYLINDOLES FOR THE TREATMENT OF HIV IDENIX (CAYMAN) LIMITED (KY) 2002-10-24 WO disclosed
US-6271251-B1 CARDIOVASCULAR DISORDERS SUMITOMO PHARMACEUTICALS COMPANY LIMITED (JP) 2001-08-07 US disclosed
US-5977100-A Substituted guanidine derivatives, process for production thereof, and pharmaceutical uses thereof SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1999-11-02 US disclosed
US-5834454-A TREATMENT OF ANGINA, ISCHEMIA, ARRHYTHMIA SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-11-10 US disclosed
EP-0787728-A1 Substituted guanidine derivatives, process for production thereof, and pharmaceutical uses thereof SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1997-08-06 EP disclosed
US-5494928-A FOR CENTRAL NERVOUS SYSTEM DISORDERS, BLOCKING SEROTONIN RECEPTORS, ANTIDEPRESSANTS HOFFMANN-LA ROCHE INC. (US) 1996-02-27 US 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 (3 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-20070293668-A1 Phenylindoles for the treatment of HIV DUT, NQO1, ENTPD5 KDM4E 1393/4885ALDH1A1 1178/4885RAB9A 2298/4885
US-20020193415-A1 Phenylindoles for the treatment of HIV DUT, NQO1, ENTPD5 KDM4E 1393/4885ALDH1A1 1178/4885RAB9A 2298/4885
US-20040180888-A1 Phenylindoles for the treatment of HIV DUT, NQO1, ENTPD5 KDM4E 1393/4885ALDH1A1 1178/4885RAB9A 2298/4885

“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.