SCHEMBL4030188

SCHEMBL4030188

COc1ccc(C(=O)c2cccc(Br)c2F)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
CYP1A2 P05177 2/20 0.47
PGR P06401 2/20 0.47
HPGD P15428 2/20 0.47
SLC6A2 P23975 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP3A4 P08684 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
AR P10275 1/20 0.47
CHRM1 P11229 1/20 0.47
ALOX15 P16050 1/20 0.47
TBXA2R P21731 1/20 0.47
ADRA1A P35348 1/20 0.47
HIF1A Q16665 1/20 0.47
RAB9A P51151 6/20 0.45
NPC1 O15118 5/20 0.45
HTT P42858 3/20 0.45
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
AHR P35869 1/20 0.40

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
SCHEMBL4030126 0.87 HPGD (0.50) LMNACYP1A2PGRHPGDSLC6A2
SCHEMBL4032529 0.86 LMNA (0.49) LMNACYP1A2PGRHPGDSLC6A2
SCHEMBL11576456 0.86 LMNA (0.55) LMNACYP1A2PGRHPGDSLC6A2
SCHEMBL1407350 0.84 KMT2A (0.50) LMNACYP1A2PGRHPGDSLC6A2
SCHEMBL4028965 0.83 KMT2A (0.55) LMNAHPGDRAB9ANPC1HTT
SCHEMBL1408466 0.82 LMNA (0.45) LMNACYP1A2PGRHPGDSLC6A2
SCHEMBL613120 0.79 LMNA (0.61) LMNACYP1A2PGRHPGDSLC6A2
SCHEMBL6379404 0.78 CPS1 (0.56) LMNACYP1A2PGRHPGDSLC6A2
SCHEMBL4028526 0.77 NPC1 (0.56) LMNACYP1A2PGRHPGDSLC6A2
SCHEMBL14830643 0.77 NPC1 (0.44) LMNAHPGDRAB9ANPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1542976-B1 SUBSTITUTED 4-(INDAZOL-3-YL)PHENOLS AS ESTROGEN RECEPTOR (ER) LIGANDS AND THEIR USE IN THE TREATMENT OF INFLAMMATORY DISEASES WYETH CORP (US) 2009-02-04 EP disclosed
US-20070225349-A1 Substituted 4-(Indazol-3-yl)phenols WYETH (US) 2007-09-27 US disclosed
US-7241791-B2 Substituted 4-(indazol-3-yl)phenols WYETH (US) 2007-07-10 US disclosed
EP-1542976-A1 SUBSTITUTED 4-(INDAZOL-3-YL)PHENOLS AS ESTROGEN RECEPTOR (ER) LIGANDS AND THEIR USE IN THE TREATMENT OF INFLAMMATORY DISEASES Wyeth (US) 2005-06-22 EP disclosed
US-20040167127-A1 Substituted 4-(indazol-3-yl)phenols WYETH (US) 2004-08-26 US disclosed
WO-2004031159-A1 SUBSTITUTED 4-(INDAZOL-3-YL)PHENOLS AS ESTROGEN RECEPTOR (ER) LIGANDS AND THEIR USE IN THE TREATMENT OF INFLAMMATORY DISEASES WYETH (US) 2004-04-15 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-20070225349-A1 Substituted 4-(Indazol-3-yl)phenols INSR, TNNI3, INSRR LMNA 4029/4885CYP1A2 2175/4885PGR 1936/4885
US-20040167127-A1 Substituted 4-(indazol-3-yl)phenols INSR, MSR1, TNNI3 LMNA 4285/4885CYP1A2 2587/4885PGR 2661/4885

“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.