SCHEMBL7036042

SCHEMBL7036042

Clc1[c]c(Cl)n(-c2ccccn2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.41
FLT3 P36888 2/20 0.40
AURKA O14965 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.40
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
OXTR P30559 1/20 0.37
AVPR1A P37288 1/20 0.37
PLD1 Q13393 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
POLB P06746 1/20 0.35
EP300 Q09472 1/20 0.35
KAT2B Q92831 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PLK4 O00444 1/20 0.35
ROCK2 O75116 1/20 0.35

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
SCHEMBL7042831 0.73 LMNA (0.42) RAB9AMAPTSMN1; SMN2L3MBTL1POLB
SCHEMBL9026693 0.70 MAPT (0.43) RAB9AFLT3AURKAIRAK4MAPT
SCHEMBL11081901 0.67 FLT3 (0.43) RAB9AFLT3AURKAIRAK4MAPT
SCHEMBL692822 0.67 MAPT (0.50) RAB9AFLT3AURKAIRAK4MAPT
SCHEMBL18949733 0.66 ALDH1A1 (0.55) RAB9AMAPTTDP1SMN1; SMN2L3MBTL1
SCHEMBL25407508 0.65 MAPT (0.48) RAB9AFLT3AURKAIRAK4MAPT
SCHEMBL535473 0.64 TDP1 (0.42) RAB9AFLT3AURKAIRAK4TDP1
SCHEMBL31675541 0.64 OXTR (0.43) RAB9AFLT3AURKAIRAK4MAPT
SCHEMBL4077901 0.64 MAPK14 (0.52) RAB9AFLT3AURKAIRAK4MAPT
SCHEMBL12335145 0.63 MAPT (0.66) RAB9AFLT3AURKAIRAK4MAPT

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-20030212116-A1 Heterocyclic imino compounds and fungicides and insecticides for agricultural and horitcultural use NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2003-11-13 US disclosed
EP-1243580-A1 HETEROCYCLIC IMINO COMPOUNDS AND FUNGICIDES AND INSECTICIDES FOR AGRICULTURAL AND HORTICULTURAL USE Nissan Chemical Industries, Ltd. (JP) 2002-09-25 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030212116-A1 Heterocyclic imino compounds and fungicides and insecticides for agricultural and horitcultural use DDT, CBR3, CYP1B1 RAB9A 4257/4885FLT3 1504/4885AURKA 3471/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.