SCHEMBL31339992

SCHEMBL31339992

O=C(O)c1cc2ccccc2c(-c2ccccc2Cl)n1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSPO P30536 5/20 0.59
KMT2A Q03164 3/20 0.59
MEN1 O00255 2/20 0.59
ALDH1A1 P00352 2/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2C9 P11712 1/20 0.59
TSHR P16473 1/20 0.59
BLM P54132 1/20 0.59
PMP22 Q01453 1/20 0.59
NR1I3 Q14994 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
CNR1 P21554 1/20 0.47
IGFBP3 P17936 2/20 0.45
KDM4E B2RXH2 1/20 0.44
GLA P06280 1/20 0.44

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
SCHEMBL3590415 1.00 TSPO (0.59) TSPOKMT2AMEN1ALDH1A1CYP3A4
SCHEMBL10984073 0.87 TSPO (0.47) TSPOKMT2AMEN1ALDH1A1CYP3A4
SCHEMBL10987170 0.87 TSPO (0.58) TSPOKMT2AMEN1ALDH1A1CYP3A4
SCHEMBL15850566 0.87 TSPO (0.61) TSPOKMT2AMEN1ALDH1A1CYP3A4
SCHEMBL10990018 0.85 KMT2A (0.50) TSPOKMT2AMEN1ALDH1A1CYP3A4
SCHEMBL3035741 0.85 KMT2A (0.46) TSPOKMT2AMEN1ALDH1A1CYP3A4
SCHEMBL3434531 0.83 TSPO (0.58) TSPOKMT2AMEN1ALDH1A1CYP3A4
SCHEMBL8470659 0.82 TSPO (0.59) TSPOKMT2AMEN1ALDH1A1CYP3A4
SCHEMBL117174 0.82 ADORA2A (0.48) TSPOKMT2AMEN1ALDH1A1CYP3A4
SCHEMBL10982335 0.82 CNR1 (0.56) TSPOKMT2AMEN1ALDH1A1CYP3A4

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-20250049839-A1 COMPOSITIONS AND METHODS FOR TARGETING CELLS CHILDREN'S MEDICAL CENTER CORPORATION (US) 2025-02-13 US disclosed
US-12161663-B2 Compositions and methods for targeting cells CHILDREN'S MEDICAL CENTER CORPORATION (US) 2024-12-10 US 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 (2 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-12161663-B2 Compositions and methods for targeting cells CD47, CD44, CX3CR1 TSPO 33/4885KMT2A 3252/4885MEN1 2860/4885
US-20250049839-A1 COMPOSITIONS AND METHODS FOR TARGETING CELLS CD47, CD44, CX3CR1 TSPO 33/4885KMT2A 3252/4885MEN1 2860/4885

“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.