SCHEMBL7717828

SCHEMBL7717828

ClCc1ccccc1CC(Cl)(Cl)Cl

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.32
PNMT P11086 1/20 0.31
IDO1 P14902 1/20 0.31

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
SCHEMBL6708534 0.82 HSPA5 (0.40) TSHRPNMTIDO1
SCHEMBL150237 0.81 TSHR (0.50) TSHRALDH1A1KMT2APNMTIDO1
SCHEMBL29350459 0.81 TSHR (0.50) TSHRALDH1A1KMT2APNMTIDO1
SCHEMBL13020681 0.78 RIPK1 (0.47) TSHRALDH1A1KMT2APNMTIDO1
Ammonia Solution, Strong SCHEMBL30821298 0.78 TSHR (0.48) TSHRALDH1A1KMT2APNMTIDO1
Hydrochloric Acid SCHEMBL9192215 0.78 TSHR (0.48) TSHRALDH1A1KMT2APNMTIDO1
Ammonia Solution, Strong SCHEMBL29017600 0.78 TSHR (0.48) TSHRALDH1A1KMT2APNMTIDO1
SCHEMBL8525795 0.75 IDO1 (0.52) TSHRPNMTIDO1
SCHEMBL7631074 0.73 HSPA5 (0.54) TSHRALDH1A1IDO1
SCHEMBL28443237 0.73 TAAR1 (0.46) TSHRALDH1A1KMT2A

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-20020106449-A1 TAILORING THE GRAFTING DENSITY OF ORGANIC MODIFIERS AT SOLID/LIQUID INTERFACES NORTH CAROLINA STATE UNIVERSITY 2002-08-08 US disclosed
US-6423372-B1 SURFACE TREATMENT OF ELASTIC SUBSTRATES, STRETCHING AND RELEASING NORTH CAROLINA STATE UNIVERSITY 2002-07-23 US disclosed