SCHEMBL4171372

SCHEMBL4171372

O=C(c1ccccc1Cl)N1CCCC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.73
RXFP1 Q9HBX9 1/20 0.72
RAB9A P51151 2/20 0.70
MEN1 O00255 1/20 0.69
POLB P06746 1/20 0.69
HPGD P15428 3/20 0.62
NPC1 O15118 1/20 0.62
GLA P06280 1/20 0.62
GAA P10253 1/20 0.62
ALDH1A1 P00352 2/20 0.61
LMNA P02545 1/20 0.61
HTT P42858 1/20 0.61
MGLL Q99685 1/20 0.59
KDM4E B2RXH2 1/20 0.59
HSD17B10 Q99714 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
HTR2B P41595 1/20 0.59
MAPK14 Q16539 1/20 0.59

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
SCHEMBL29944094 0.98 KMT2A (0.72) KMT2ARXFP1RAB9AMEN1POLB
SCHEMBL3454984 0.98 KMT2A (0.72) KMT2ARXFP1RAB9AMEN1POLB
SCHEMBL3456393 0.98 KMT2A (0.72) KMT2ARXFP1RAB9AMEN1POLB
SCHEMBL10723816 0.92 RAB9A (0.80) KMT2ARXFP1RAB9AMEN1POLB
SCHEMBL10720608 0.86 TSHR (0.69) KMT2AMEN1POLBHPGDGLA
(2-Chlorophenyl)(Morpholino)Methanone SCHEMBL6938284 0.84 MGLL (0.68) KMT2ARXFP1RAB9AGAAALDH1A1
SCHEMBL6673835 0.84 RXFP1 (1.00) KMT2ARXFP1RAB9AMEN1POLB
SCHEMBL13503827 0.84 KMT2A (0.88) KMT2ARXFP1RAB9AMEN1POLB
SCHEMBL29944015 0.84 HPGD (0.67) KMT2ARXFP1MEN1POLBHPGD
SCHEMBL23793444 0.82 HPGD (0.73) KMT2ARXFP1RAB9AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105292-A9 Glucocorticoid Receptor Modulator Compounds and Methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2009-04-23 US disclosed
US-20070281959-A1 Glucocorticoid receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2007-12-06 US disclosed
US-4221805-A N-(2-CHLOROBENZYL)PYRROLIDINE QUADRO GIUSEPPE 1980-09-09 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-20090105292-A9 Glucocorticoid Receptor Modulator Compounds and Methods NR3C1, NR3C2, MC2R KMT2A 4088/4885RXFP1 826/4885RAB9A 3084/4885
US-20070281959-A1 Glucocorticoid receptor modulator compounds and methods NR3C1, NR3C2, MC2R KMT2A 4088/4885RXFP1 826/4885RAB9A 3084/4885

“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.