SCHEMBL21080314

SCHEMBL21080314

COC(=O)[C@H](CO[Si](C)(C)C(C)(C)C)N(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPOR P19235 2/20 0.46
BTN3A1 O00481 2/20 0.38
ADRB2 P07550 2/20 0.38
ADRB1 P08588 2/20 0.38
ADRB3 P13945 2/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
RECQL P46063 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
HSD17B10 Q99714 1/20 0.36
AKT1 P31749 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL21080317 1.00 EPOR (0.46) EPORBTN3A1ADRB2ADRB1ADRB3
SCHEMBL19999331 0.92 EPOR (0.40) EPORBTN3A1ADRB2ADRB1ADRB3
SCHEMBL13672330 0.85 EPOR (0.44) EPORMEN1KMT2ANPC1RAB9A
SCHEMBL14935460 0.81 EPOR (0.53) EPORMEN1KMT2ANPC1RAB9A
SCHEMBL14935601 0.81 EPOR (0.53) EPORMEN1KMT2ANPC1RAB9A
SCHEMBL8710569 0.78 FOLH1 (0.43) ADRB2ADRB1ADRB3MEN1KMT2A
SCHEMBL3854880 0.77 EPOR (0.54) EPORMEN1KMT2ANPC1RAB9A
SCHEMBL83747 0.77 EPOR (0.54) EPORMEN1KMT2ANPC1RAB9A
SCHEMBL1697393 0.77 EPOR (0.54) EPORMEN1KMT2ANPC1RAB9A
SCHEMBL3363612 0.77 EPOR (0.54) EPORMEN1KMT2ANPC1RAB9A

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
EP-3583105-B1 PYRROLO [1,2-B]PYRIDAZINE DERIVATIVES GILEAD SCIENCES INC (US) 2024-02-07 EP disclosed
US-10336762-B2 Pyrrolo[1,2-b]pyridazine derivatives GILEAD SCIENCES, INC. (US) 2019-07-02 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 (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-10336762-B2 Pyrrolo[1,2-b]pyridazine derivatives SDHB, CYP4F2, CYP1B1 EPOR 423/4885BTN3A1 2903/4885ADRB2 651/4885

“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.