SCHEMBL23935877

SCHEMBL23935877

N=C(NCc1cccc(Cl)c1)NC(=N)N1CCC(F)(F)CC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 1/20 0.42
▸ CNR1 P21554 1/20 0.42
▸ CNR2 P34972 1/20 0.42
▸ MAOB P27338 1/20 0.40
▸ HTR6 P50406 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ P2RX7 Q99572 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ ROCK2 O75116 1/20 0.38
▸ CHRM2 P08172 1/20 0.37
▸ CHRM3 P20309 1/20 0.37

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
SCHEMBL23935916 0.86 METAP2 (0.42) METAP2MAPTKMT2AMEN1POLB
SCHEMBL18190981 0.86 MTOR (0.39) MAPTKMT2AMEN1POLB
SCHEMBL28487664 0.85 HRH3 (0.45) P2RX7KMT2AMEN1LMNAPOLB
Hydrochloric Acid SCHEMBL18191032 0.84 HRH3 (0.44) KMT2AMEN1LMNAPOLB
SCHEMBL17777323 0.83 KMT2A (0.44) PKMMAPTKMT2AMEN1LMNA
Acetic Acid SCHEMBL18190965 0.81 SMN1; SMN2 (0.40) MAPTKMT2AMEN1LMNAPOLB
SCHEMBL18197821 0.78 HRH3 (0.43) P2RX7KMT2AMEN1LMNAPOLB
SCHEMBL18191042 0.78 TGM2 (0.38) LMNA
SCHEMBL18197810 0.78 MLYCD (0.41) PKMKMT2AMEN1
SCHEMBL20023235 0.78 SCN3A (0.37) LMNAROCK2

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-3288918-B1 GUANIDINE COMPOUNDS AND USE THEREOF IMMUNOMET THERAPEUTICS INC (US) 2021-10-20 — — EP disclosed
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