SCHEMBL31723221

SCHEMBL31723221

Cc1c(N)cc(F)cc1N(C)c1cccc(F)c1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.38
ACHE P22303 1/20 0.36
DHFR P00374 1/20 0.36
F2 P00734 1/20 0.35
F10 P00742 1/20 0.35
TAAR1 Q96RJ0 2/20 0.35
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
HTR7 P34969 1/20 0.33
GRM5 P41594 1/20 0.32
ATR Q13535 1/20 0.32
ATRIP Q8WXE1 1/20 0.32
CETP P11597 1/20 0.32

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
SCHEMBL29454066 1.00 ABCG2 (0.38) ABCG2ACHEDHFRF2F10
SCHEMBL22232350 1.00 ABCG2 (0.38) ABCG2ACHEDHFRF2F10
SCHEMBL22232258 0.89 ACHE (0.39) ACHEDHFRF2F10SLC6A2
SCHEMBL29454111 0.89 ACHE (0.39) ACHEDHFRF2F10SLC6A2
SCHEMBL31723240 0.89 ACHE (0.39) ACHEDHFRF2F10SLC6A2
SCHEMBL31723210 0.87 CHKA (0.37) ABCG2DHFRF2F10KMT2A
SCHEMBL29454049 0.87 CHKA (0.37) ABCG2DHFRF2F10KMT2A
SCHEMBL22231907 0.87 ABCG2 (0.36) ABCG2ACHEDHFRF2F10
SCHEMBL31723238 0.87 ABCG2 (0.36) ABCG2ACHEDHFRF2F10
SCHEMBL29454192 0.87 ABCG2 (0.36) ABCG2ACHEDHFRF2F10

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-4647426-A2 3-SUBSTITUTED PHENYLAMIDINE COMPOUNDS, PREPARATION AND USE THEREOF PI Industries Ltd. (IN) 2025-11-12 EP claimed