SCHEMBL10562435

SCHEMBL10562435

O=C(Cl)c1ccnnc1Cl

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CASP1 P29466 6/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ KDM5B Q9UGL1 1/20 0.34
▸ P2RX7 Q99572 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HCAR2 Q8TDS4 1/20 0.30
▸ AHR P35869 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
SCHEMBL31092459 0.83 SMN1; SMN2 (0.53) LMNASMN1; SMN2CASP1ALDH1A1ALOX15
SCHEMBL1623759 0.83 SMN1; SMN2 (0.53) LMNASMN1; SMN2CASP1ALDH1A1ALOX15
SCHEMBL31092388 0.81 CASP1 (0.49) CASP1ALDH1A1P2RX7KDM4E
Hydrochloric Acid SCHEMBL10562444 0.81 SMN1; SMN2 (0.52) LMNASMN1; SMN2CASP1ALDH1A1ALOX15
SCHEMBL2050026 0.79 SMN1; SMN2 (0.37) LMNASMN1; SMN2CASP1ALDH1A1KDM5B
SCHEMBL28161593 0.78 ALDH1A1 (0.39) ALDH1A1ALOX15KDM5BKDM4EHCAR2
SCHEMBL29244521 0.76 KDM4E (0.46) LMNASMN1; SMN2ALDH1A1KDM5BKDM4E
SCHEMBL23458578 0.75 MEN1 (0.46) LMNASMN1; SMN2CASP1ALDH1A1KDM4E
SCHEMBL1623223 0.72 CASP1 (0.56) CASP1ALDH1A1KDM4EMAPT
SCHEMBL8309693 0.71 CA12 (0.44) CASP1ALDH1A1KDM4EMAPT

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-RE32975-E FUNGICIDES, BACTERICIDES, FEED ADDITIVES BAYER AKTIENGESELLSCHAFT (DE) 1989-07-04 — — US disclosed
US-4284629-A ANIMAL GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1981-08-18 — — US disclosed
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