SCHEMBL6172091

SCHEMBL6172091

O=C1CCCc2cc(OC(Cn3ccnc3)c3ccccc3)ccc21

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 9/20 0.47
▸ MAOB P27338 9/20 0.47
▸ CYP19A1 P11511 1/20 0.46
▸ PTGS2 P35354 1/20 0.42
▸ HMOX2 P30519 1/20 0.39

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
SCHEMBL6841878 1.00 MAOA (0.47) MAOAMAOBCYP19A1PTGS2HMOX2
SCHEMBL6985342 0.90 MAOA (0.49) MAOAMAOBCYP19A1PTGS2
SCHEMBL6841876 0.81 CYP19A1 (0.42) CYP19A1PTGS2HMOX2
SCHEMBL6307113 0.80 CYP19A1 (0.39) CYP19A1PTGS2
SCHEMBL6171100 0.79 MIF (0.48) CYP19A1PTGS2
SCHEMBL6171106 0.79 MIF (0.48) CYP19A1PTGS2
SCHEMBL6299812 0.79 CYP19A1 (0.42) CYP19A1PTGS2HMOX2
SCHEMBL6300300 0.79 CYP19A1 (0.42) CYP19A1PTGS2HMOX2
SCHEMBL6703598 0.79 CYP19A1 (0.45) CYP19A1PTGS2
SCHEMBL6299533 0.79 CYP19A1 (0.40) CYP19A1PTGS2HMOX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0966446-B1 BICYCLIC INHIBITORS OF PROTEIN FARNESYL TRANSFERASE WARNER LAMBERT CO (US) 2005-10-19 — — EP claimed
US-20040063770-A1 Method for treating Alzheimer's disease WARNER-LAMBERT COMPANY 2004-04-01 — — US claimed
US-20020006936-A1 Bicyclic inhibitors of protein farnesyl transferase BIKKER JACK (US) 2002-01-17 — — US claimed
US-20010051642-A1 Method for treating Alzheimer's disease AHN KYUNGHYE (US) 2001-12-13 — — US claimed
US-6265422-B1 ANTICANCER AGENTS; CARDIOVASCULAR DISORDERS WARNER-LAMBERT COMPANY 2001-07-24 — — US claimed
EP-0966446-B1 BICYCLIC INHIBITORS OF PROTEIN FARNESYL TRANSFERASE WARNER LAMBERT CO (US) 2005-10-19 — — EP disclosed
US-6943183-B2 5-substituted tetralones as inhibitors of ras farnesyl transferase PFIZER INC (US) 2005-09-13 — — US disclosed
US-20040063770-A1 Method for treating Alzheimer's disease WARNER-LAMBERT COMPANY 2004-04-01 — — US disclosed
US-20040044057-A1 5- substituted tetralones as inhibitors of ras farnesyl trransferase WARNER-LAMBERT COMPANY 2004-03-04 — — US disclosed
US-6528535-B2 Anticancer agents; restenosis WARNER-LAMBERT COMPANY 2003-03-04 — — US disclosed
EP-1276725-A2 5-SUBSTITUTED TETRALONES AS INHIBITORS OF RAS FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 2003-01-22 — — EP disclosed
US-20020006936-A1 Bicyclic inhibitors of protein farnesyl transferase BIKKER JACK (US) 2002-01-17 — — US disclosed
US-20010051642-A1 Method for treating Alzheimer's disease AHN KYUNGHYE (US) 2001-12-13 — — US disclosed
WO-2001079180-A2 5-SUBSTITUTED TETRALONES AS INHIBITORS OF RAS FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 2001-10-25 — — WO disclosed
US-6265422-B1 ANTICANCER AGENTS; CARDIOVASCULAR DISORDERS WARNER-LAMBERT COMPANY 2001-07-24 — — US disclosed
US-6133303-A VARIOUS INDENE DERIVATIVES, WITH THE EXCEPTION OF 5-(2-IMIDAZOLE-1-YL-ETHOXY)INDAN-1-ONE; TREATING CANCER AND TREATING OR PREVENTING RESTENOSIS OR ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 2000-10-17 — — US disclosed
EP-0966446-A1 BICYCLIC INHIBITORS OF PROTEIN FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 1999-12-29 — — EP disclosed
WO-1998034921-A1 BICYCLIC INHIBITORS OF PROTEIN FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 1998-08-13 — — 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 (4 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-20040063770-A1 Method for treating Alzheimer's disease BACE1, BACE2, PSEN1 MAOA 116/4885MAOB 139/4885CYP19A1 203/4885
US-20010051642-A1 Method for treating Alzheimer's disease BACE1, BACE2, PSEN1 MAOA 116/4885MAOB 139/4885CYP19A1 203/4885
US-20040044057-A1 5- substituted tetralones as inhibitors of ras farnesyl trransferase PTAR1, FNTA, GGPS1 MAOA 3197/4885MAOB 2947/4885CYP19A1 962/4885
US-20020006936-A1 Bicyclic inhibitors of protein farnesyl transferase FNTA, FNTB, SREBF1 MAOA 3541/4885MAOB 3449/4885CYP19A1 1064/4885

“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.

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