SCHEMBL11879802

SCHEMBL11879802

O=P(Cl)(CC(Br)CBr)CC(Br)CBr

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41

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
SCHEMBL4417447 0.72
SCHEMBL11355544 0.67 ALDH1A1 (0.36) ALDH1A1
SCHEMBL11871906 0.67 TP53 (0.39) ALDH1A1
SCHEMBL11324963 0.67 ALDH1A1 (0.36) ALDH1A1
SCHEMBL28002947 0.65
SCHEMBL11443316 0.64 TSHR (0.46)
SCHEMBL11837842 0.64 ALDH1A1 (0.33) ALDH1A1
SCHEMBL66165 0.63
2,3-Dibromopropanol SCHEMBL11862274 0.61 ALDH1A1 (0.72) ALDH1A1
SCHEMBL11571066 0.61 ANPEP (0.32) ALDH1A1

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-3864436-A Process For The Preparation Of Bis-(2,3-Dibromopropyl) Phosphoryl Chloride NAT STARCH CHEM CORP 1975-02-04 US disclosed
US-3864436-A Process For The Preparation Of Bis-(2,3-Dibromopropyl) Phosphoryl Chloride NAT STARCH CHEM CORP 1975-02-04 US disclosed