SCHEMBL6587897

SCHEMBL6587897

O=C(c1ccc(Cl)cc1)n1ccc2ccccc21

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.75
TSHR P16473 1/20 0.75
L3MBTL1 Q9Y468 1/20 0.75
KMT2A Q03164 3/20 0.55
NOTUM Q6P988 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.51
MAPT P10636 1/20 0.51
BIRC5 O15392 1/20 0.49
POLB P06746 1/20 0.48
F12 P00748 1/20 0.48
SLC22A12 Q96S37 3/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
P2RX4 Q99571 1/20 0.43

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
SCHEMBL1413391 0.86 RAB9A (1.00) RAB9ATSHRL3MBTL1KMT2ANOTUM
SCHEMBL31435512 0.86 RAB9A (1.00) RAB9ATSHRL3MBTL1KMT2ANOTUM
SCHEMBL31435488 0.83 RAB9A (0.75) RAB9ATSHRL3MBTL1KMT2ANOTUM
SCHEMBL7010604 0.83 TSHR (0.69) RAB9ATSHRL3MBTL1KMT2ANOTUM
SCHEMBL31435522 0.81 RAB9A (0.66) RAB9ATSHRL3MBTL1KMT2ASLC22A12
SCHEMBL29808604 0.80 TSHR (0.53) RAB9ATSHRL3MBTL1KMT2ASLC22A12
SCHEMBL9263968 0.80 TSHR (0.75) RAB9ATSHRL3MBTL1KMT2ANOTUM
SCHEMBL31435524 0.80 TSHR (0.70) RAB9ATSHRL3MBTL1KMT2ANOTUM
SCHEMBL28243567 0.80 TSHR (0.69) RAB9ATSHRL3MBTL1KMT2ANOTUM
SCHEMBL8447109 0.77 RAB9A (0.60) RAB9ATSHRL3MBTL1KMT2ANOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0901470-B1 INDOLE DERIVATIVES USEFUL AS ENDOTHELIN RECEPTOR ANTAGONISTS PFIZER (US) 2004-03-31 EP disclosed
US-6384070-B2 RESTENOSIS, KIDNEY DISEASES, LUNG DISEASES PFIZER INC. 2002-05-07 US disclosed
US-6306852-B1 INDOLE DERIVATIVES USEFUL IN THE TREATMENT OF A VARIETY OF DISEASES INCLUDING RESTENOSIS, RENAL FAILURE AND PULMONARY HYPERTENSION, AND TO PHARMACEUTICAL FORMULATIONS CONTAINING SUCH COMPOUNDS. PFIZER INC. 2001-10-23 US disclosed
US-20010014677-A1 Restenosis, kidney diseases, lung diseases RAWSON DAVID JAMES (GB) 2001-08-16 US disclosed
US-6211223-B1 BENZODIOXOL-5-YL-2-METHOXY-4-METHYLPHENYLSULFONYLAMINO-2-OXO ETHYL-1-METHYL-1HINDOLE-6-CARBOXYLIC ACID PFIZER INC. 2001-04-03 US disclosed
US-6136843-A CARDIOVASCULAR DISORDERS; KIDNEY DISORDERS PFIZER INC (US) 2000-10-24 US disclosed
US-6017945-A USEFUL IN THE TREATMENT OF RESTENOSIS, RENAL FAILURE AND PULMONARY HYPERTENSION PFIZER INC. (US) 2000-01-25 US disclosed
WO-1999020623-A1 INDOLE DERIVATIVE USEFUL AS ENDOTHELIN RECEPTOR ANTAGONIST PFIZER LIMITED (GB) 1999-04-29 WO disclosed
EP-0901470-A1 INDOLE DERIVATIVES USEFUL AS ENDOTHELIN RECEPTOR ANTAGONISTS PFIZER INC. (US) 1999-03-17 EP disclosed
WO-1997043260-A1 INDOLE DERIVATIVES USEFUL AS ENDOTHELIN RECEPTOR ANTAGONISTS PFIZER INC. (US) 1997-11-20 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 (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-20010014677-A1 Restenosis, kidney diseases, lung diseases NR1H2, NR1H3, NR1H4 RAB9A 1408/4885TSHR 167/4885L3MBTL1 1319/4885

“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.