SCHEMBL11229290

SCHEMBL11229290

N=C(NN=Cc1ccc(Cl)cc1)NN=Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.57
ALDH1A1 P00352 2/20 0.57
SMN1; SMN2 Q16637 3/20 0.49
XBP1 P17861 1/20 0.47
TUBB4A P04350 1/20 0.46
TUBB P07437 1/20 0.46
TUBA3C P0DPH7 1/20 0.46
TUBA1B P68363 1/20 0.46
TUBA4A P68366 1/20 0.46
TUBB4B P68371 1/20 0.46
TUBB3 Q13509 1/20 0.46
TUBB2A Q13885 1/20 0.46
TUBB8 Q3ZCM7 1/20 0.46
TUBA3E Q6PEY2 1/20 0.46
TUBA1A Q71U36 1/20 0.46
TUBA1C Q9BQE3 1/20 0.46
TUBB6 Q9BUF5 1/20 0.46
TUBB2B Q9BVA1 1/20 0.46
TUBB1 Q9H4B7 1/20 0.46
EGFR P00533 1/20 0.46

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
SCHEMBL11229287 1.00 LMNA (0.57) LMNAALDH1A1SMN1; SMN2XBP1TUBB4A
Hydrochloric Acid SCHEMBL11768981 0.98 LMNA (0.56) LMNAALDH1A1SMN1; SMN2XBP1TUBB4A
Hydrochloric Acid SCHEMBL11768975 0.98 LMNA (0.56) LMNAALDH1A1SMN1; SMN2XBP1TUBB4A
SCHEMBL10662338 0.92 LMNA (0.66) LMNAALDH1A1SMN1; SMN2XBP1MAPT
SCHEMBL10662351 0.92 LMNA (0.66) LMNAALDH1A1SMN1; SMN2XBP1MAPT
Hydrochloric Acid SCHEMBL11769085 0.91 LMNA (0.64) LMNAALDH1A1SMN1; SMN2XBP1MAPT
Hydrochloric Acid SCHEMBL11768006 0.91 LMNA (0.64) LMNAALDH1A1SMN1; SMN2XBP1MAPT
SCHEMBL19449618 0.88 LMNA (0.48) LMNAALDH1A1SMN1; SMN2XBP1TUBB4A
SCHEMBL16224319 0.88 LMNA (0.48) LMNAALDH1A1SMN1; SMN2XBP1TUBB4A
Robenidine SCHEMBL6729906 0.87 SMN1; SMN2 (0.53) LMNAALDH1A1SMN1; SMN2XBP1MAPT

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-4310541-A WITH A BIS(BENZYLIDENEAMINO)GUANIDINE MERCK & CO., INC. (US) 1982-01-12 US claimed
US-4310541-A WITH A BIS(BENZYLIDENEAMINO)GUANIDINE MERCK & CO., INC. (US) 1982-01-12 US disclosed