Pyrrolidine

Pyrrolidine

SCHEMBL3692242

C1CCNC1.O=C(O)C(NCCCc1ccc(F)cc1)C(O)c1ccc(O)c(O)c1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 5/20 0.37
▸ BLM P54132 4/20 0.37
▸ LMNA P02545 2/20 0.37
▸ NR1I2 O75469 1/20 0.37
▸ PTGS1 P23219 1/20 0.37
▸ ADRA1A P35348 1/20 0.37
▸ ADRB2 P07550 5/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ MAPT P10636 3/20 0.36
▸ HSD17B10 Q99714 3/20 0.36
▸ POLB P06746 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ RXFP1 Q9HBX9 2/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ NFKB1 P19838 2/20 0.36
▸ HIF1A Q16665 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ TP53 P04637 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
Pyrrolidine SCHEMBL3692249 1.00 TDP1 (0.37) TDP1BLMLMNANR1I2PTGS1
Bromide SCHEMBL29900646 0.80 MCHR1 (0.35) ADRA1AADRB2MAPTTSHRMEN1
SCHEMBL3692247 0.79 CACNA1F (0.36) ADRA1AADRB2TSHRADRB1SLC6A2
SCHEMBL10601518 0.73 TDP1 (0.48) TDP1BLMLMNANR1I2PTGS1
SCHEMBL6686411 0.73 TDP1 (0.48) TDP1BLMLMNANR1I2PTGS1
SCHEMBL10601279 0.73 TDP1 (0.48) TDP1BLMLMNANR1I2PTGS1
SCHEMBL11537605 0.70 ADRB1 (0.47) LMNAADRA1AADRB2HIF1AADRB1
SCHEMBL10763030 0.68 TDP1 (0.54) TDP1BLMLMNANR1I2PTGS1
SCHEMBL10763032 0.68 TDP1 (0.54) TDP1BLMLMNANR1I2PTGS1
SCHEMBL7272479 0.68 TDP1 (0.50) TDP1BLMLMNANR1I2PTGS1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100009934-A1 BETA ADRENERGIC RECEPTOR AGONISTS FOR THE TREATMENT OF B-CELL PROLIFERATIVE DISORDERS COMBINATORX, INCORPORATED (US) 2010-01-14 — — 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-20100009934-A1 BETA ADRENERGIC RECEPTOR AGONISTS FOR THE TREATMENT OF B-CELL PROLIFERATIVE DISORDERS ADRB1, ADRB2, ADRA2B TDP1 1539/4885BLM 966/4885LMNA 1533/4885

“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.

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