SCHEMBL10798796

SCHEMBL10798796

Cc1ccc(C(Cl)NC(N)(Cl)c2ccc(C)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ TSHR P16473 1/20 0.34
▸ HPGD P15428 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CHRNA7 P36544 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA5A P35218 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ TP53 P04637 1/20 0.30

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
SCHEMBL10794158 0.78 DPP4 (0.38) LMNATSHR
SCHEMBL3667462 0.67 TSHR (0.50) ALDH1A1TSHRHPGDCA1CA2
SCHEMBL2120702 0.66 TSHR (0.55) ALDH1A1TSHRCHRNA7CA1CA2
SCHEMBL11289948 0.65 CHRNA7 (0.42) LMNASMN1; SMN2ALDH1A1TSHRHPGD
SCHEMBL1409623 0.64 TSHR (0.60) ALDH1A1TSHRMEN1KMT2ACA1
SCHEMBL6049865 0.63 TSHR (0.58) LMNAALDH1A1TSHRHPGDCA1
Iodide SCHEMBL25233686 0.62 TSHR (0.57) ALDH1A1TSHRMEN1KMT2ACA1
SCHEMBL6403156 0.62 ACHE (0.44) LMNASMN1; SMN2ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL16447038 0.62 TSHR (0.57) ALDH1A1TSHRMEN1KMT2ACA1
SCHEMBL3676489 0.62 TSHR (0.44) TSHRHPGDCA1CA2CA5A

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
EP-0088667-B1 HALOGENATED AROMATIC DIAMINES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THE PREPARATION OF POLYURETHANES ELF ATOCHEM S.A. (FR) 1987-04-08 — — EP claimed
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