SCHEMBL28536289

SCHEMBL28536289

CCCCCCl.NC(=O)Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.60
ALDH1A1 P00352 5/20 0.60
TDP1 Q9NUW8 3/20 0.50
TP53 P04637 2/20 0.46
FAAH O00519 3/20 0.45
CES2 O00748 4/20 0.42
CES1 P23141 4/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
AKR1B1 P15121 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
SOAT1 P35610 1/20 0.40
PPARG P37231 5/20 0.39
PPARD Q03181 5/20 0.39
PPARA Q07869 5/20 0.39
HDAC11 Q96DB2 4/20 0.39
GPR84 Q9NQS5 3/20 0.39
TLR2 O60603 2/20 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
Urea SCHEMBL1907459 0.92 TSHR (0.63) TSHRALDH1A1TDP1TP53FAAH
Carbamic Acid SCHEMBL11497585 0.90 TSHR (0.60) TSHRALDH1A1TDP1FAAHCES2
SCHEMBL27759501 0.89 TSHR (0.67) TSHRALDH1A1TDP1TP53FAAH
Carbamic Acid SCHEMBL27915395 0.87 TSHR (0.57) TSHRALDH1A1TDP1FAAHCES2
Carbamic Acid SCHEMBL10844466 0.87 TSHR (0.65) TSHRALDH1A1TDP1FAAHCES2
Aminomethylamide SCHEMBL28857413 0.85 TSHR (0.55) TSHRALDH1A1TDP1TP53FAAH
Urea SCHEMBL28786996 0.85 TSHR (0.55) TSHRALDH1A1TDP1TP53FAAH
SCHEMBL10773744 0.84 TSHR (0.68) TSHRALDH1A1TDP1FAAHCES2
SCHEMBL27988691 0.84 TSHR (0.60) TSHRALDH1A1TDP1TP53FAAH
SCHEMBL27690953 0.84 TSHR (0.60) TSHRALDH1A1TDP1TP53FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-212623259-U Tail cable for jumper connection optical equipment 武汉金锐立科技有限公司 2021-02-26 CN disclosed