SCHEMBL11802140

SCHEMBL11802140

ClCC(Cl)Oc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
TSHR P16473 2/20 0.38
LTA4H P09960 1/20 0.38
KCNA3 P22001 1/20 0.37
SLC6A4 P31645 3/20 0.36
PPARG P37231 6/20 0.36
PPARA Q07869 6/20 0.36
SLC6A2 P23975 2/20 0.36
SLC6A3 Q01959 2/20 0.36
CA4 P22748 1/20 0.35
LMNA P02545 1/20 0.34
TAAR1 Q96RJ0 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RECQL P46063 1/20 0.33
POLB P06746 1/20 0.33
SCN4A P35499 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
SCHEMBL28057724 0.79 MTNR1A (0.38) MTNR1AMTNR1BTSHRLTA4HKCNA3
SCHEMBL8108204 0.79 MTNR1A (0.42) MTNR1AMTNR1BTSHRLTA4HKCNA3
SCHEMBL6482154 0.79 TAAR1 (0.41) MTNR1AMTNR1BTSHRLTA4HKCNA3
SCHEMBL11208071 0.79 KCNA3 (0.41) MTNR1AMTNR1BTSHRKCNA3SLC6A4
SCHEMBL15349936 0.77 LMNA (0.50) MTNR1AMTNR1BKCNA3PPARGPPARA
SCHEMBL10372698 0.76 SLC6A4 (0.41) MTNR1AMTNR1BLTA4HSLC6A4PPARG
SCHEMBL28025173 0.76 LMNA (0.44) LMNA
SCHEMBL9674388 0.74 MTNR1A (0.50) MTNR1AMTNR1BLTA4HSLC6A4SLC6A2
SCHEMBL10358911 0.74 LMNA (0.42) MTNR1AMTNR1BTSHRLTA4HKCNA3
SCHEMBL8089903 0.74 CYP2C19 (0.39) MTNR1AMTNR1BTSHRLTA4HKCNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3981888-A Process for preparing (1-oxo-2-phenyl, halophenyl or thienyl-2-methyl-6,7-dichloro-5-indanyloxy)acetic acid MERCK & CO., INC. (US) 1976-09-21 US disclosed
US-3950408-A Process for preparing [1-oxo-2-cyclopentyl (or 2-isopropyl)-2-methyl-6,7-dichloro-5-indanyloxy] acetic acid MERCK & CO., INC. (US) 1976-04-13 US disclosed