SCHEMBL7106433

SCHEMBL7106433

[CH2]CCc1ccc(-c2ccccc2)[nH]1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.61
CYP2C9 P11712 1/20 0.61
HSD17B10 Q99714 1/20 0.61
HTR6 P50406 1/20 0.41
NOTUM Q6P988 1/20 0.39
KDM4E B2RXH2 3/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
GLA P06280 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PDE10A Q9Y233 1/20 0.36
GAA P10253 1/20 0.34
GFER P55789 1/20 0.34
POLB P06746 1/20 0.34
NPY5R Q15761 1/20 0.34
SCN2A Q99250 1/20 0.34
NQO2 P16083 1/20 0.33

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
SCHEMBL28170953 0.88 CYP1A2 (0.59) CYP1A2CYP2C9HSD17B10HTR6NOTUM
SCHEMBL5503791 0.76 CYP1A2 (0.56) CYP1A2CYP2C9HSD17B10HTR6MAPT
SCHEMBL14310615 0.76 HSD17B10 (0.60) CYP1A2CYP2C9HSD17B10HTR6NOTUM
SCHEMBL5717770 0.76 HSD17B10 (1.00) CYP1A2CYP2C9HSD17B10NOTUMKDM4E
SCHEMBL22734764 0.75 CYP1A2 (0.55) CYP1A2CYP2C9HSD17B10HTR6NOTUM
SCHEMBL4491047 0.73 CYP1A2 (0.53) CYP1A2CYP2C9HSD17B10HTR6NOTUM
SCHEMBL5274426 0.73 CYP1A2 (0.76) CYP1A2CYP2C9HSD17B10HTR6NOTUM
SCHEMBL1536003 0.72 NOTUM (0.56) CYP1A2CYP2C9HSD17B10NOTUMKDM4E
SCHEMBL23303471 0.71 CYP1A2 (0.50) CYP1A2CYP2C9HSD17B10HTR6NOTUM
SCHEMBL22734803 0.71 CYP1A2 (0.50) CYP1A2CYP2C9HSD17B10HTR6NOTUM

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
EP-0952157-B1 9A, 11B-Dehydro derivatives of 9-oxime-3-keto-6-0-methylerythromycin PFIZER PROD INC (US) 2003-06-18 EP claimed
US-6482801-B2 THERAPY FOR BACTERIAL OR PROTOZOA INFECTIONS PFIZER INC. 2002-11-19 US claimed
US-6262030-B1 Erythromycin derivatives PFIZER INC. 2001-07-17 US claimed
US-6248719-B1 Tricyclic 3-keto derivatives of 6-O-methylerthromycin PFIZER INC 2001-06-19 US claimed
WO-1999062920-A1 TRICYCLIC 3-KETO DERIVATIVES OF 6-O-METHYLERYTHROMYCIN PFIZER PRODUCTS INC. (US) 1999-12-09 WO claimed
EP-0952157-A1 9A, 11B-Dehydro derivatives of 9-oxime-3-keto-6-0-methylerythromycin Pfizer Products Inc. (US) 1999-10-27 EP claimed
EP-0952157-B1 9A, 11B-Dehydro derivatives of 9-oxime-3-keto-6-0-methylerythromycin PFIZER PROD INC (US) 2003-06-18 EP disclosed
US-6482801-B2 THERAPY FOR BACTERIAL OR PROTOZOA INFECTIONS PFIZER INC. 2002-11-19 US disclosed
US-20010016574-A1 9a,11b-dehydro derivatives of 9-oxime-3-keto-6-O- methylerythromycin WU YONG-JIN (US) 2001-08-23 US disclosed
US-6262030-B1 Erythromycin derivatives PFIZER INC. 2001-07-17 US disclosed
WO-1999062920-A1 TRICYCLIC 3-KETO DERIVATIVES OF 6-O-METHYLERYTHROMYCIN PFIZER PRODUCTS INC. (US) 1999-12-09 WO disclosed
EP-0952157-A1 9A, 11B-Dehydro derivatives of 9-oxime-3-keto-6-0-methylerythromycin Pfizer Products Inc. (US) 1999-10-27 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-20010016574-A1 9a,11b-dehydro derivatives of 9-oxime-3-keto-6-O- methylerythromycin CYP7A1, HSD17B7, CYP51A1 CYP1A2 40/4885CYP2C9 24/4885HSD17B10 102/4885

“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.