SCHEMBL3310693

SCHEMBL3310693

O=C(c1cn[nH]c1)N1CCCC1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 12/20 0.52
ALDH1A1 P00352 2/20 0.52
PROKR1 Q8TCW9 1/20 0.47
RIPK1 Q13546 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 2/20 0.46
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
MLYCD O95822 1/20 0.42
USP2 O75604 1/20 0.42
TSHR P16473 1/20 0.41
HSD11B1 P28845 1/20 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
SCHEMBL17276467 0.98 HPGD (0.55) HPGDALDH1A1PROKR1RIPK1MEN1
SCHEMBL21259942 0.96 PROKR1 (0.47) HPGDALDH1A1PROKR1RIPK1MEN1
SCHEMBL28471523 0.86 RIPK1 (0.45) HPGDALDH1A1PROKR1RIPK1MEN1
SCHEMBL13751474 0.84 POLB (0.50) HPGDRIPK1MEN1KMT2AKDM4E
SCHEMBL1178863 0.84 SMN1; SMN2 (0.53) HPGDALDH1A1RIPK1KMT2AKDM4E
SCHEMBL13741680 0.80 HRH3 (0.50)
SCHEMBL12698682 0.80 CA12 (0.54) HPGDALDH1A1PROKR1RIPK1MEN1
SCHEMBL5159792 0.78 GAA (0.38) ALDH1A1PROKR1MEN1KMT2AL3MBTL1
SCHEMBL22874860 0.78 RIPK1 (0.48) HPGDALDH1A1PROKR1RIPK1MEN1
SCHEMBL18689713 0.78 SPR (0.51) PROKR1RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260116881-A1 KIF MODULATOR COMPOUNDS AND METHODS OF USE IAMBIC THERAPEUTICS INC (US) 2026-04-30 US disclosed
US-10385057-B2 Pyrazole compounds and methods of making and using same LUNDBECK LA JOLLA RESEARCH CENTER, INC. (US) 2019-08-20 US disclosed
US-10385057-B2 Pyrazole compounds and methods of making and using same LUNDBECK LA JOLLA RESEARCH CENTER, INC. (US) 2019-08-20 US disclosed
US-20180327410-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2018-11-15 US disclosed
US-10093630-B2 Pyrazole compounds and methods of making and using same ABIDE THERAPEUTICS, INC. (US) 2018-10-09 US disclosed
US-20170190669-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2017-07-06 US disclosed
US-20170190669-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2017-07-06 US disclosed
US-20170190669-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2017-07-06 US disclosed
WO-2015179559-A2 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME ABIDE THERAPEUTICS, INC. (US) 2015-11-26 WO disclosed
WO-2015179559-A2 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME ABIDE THERAPEUTICS, INC. (US) 2015-11-26 WO disclosed
US-20100113776-A1 PYRAZOLE DERIVATIVE TAISHO PHARMACEUTICAL CO.,LTD. (JP) 2010-05-06 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 (6 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-20260116881-A1 KIF MODULATOR COMPOUNDS AND METHODS OF USE KIF2C, KIF5B, KIF5C HPGD 4099/4885ALDH1A1 2556/4885PROKR1 2316/4885
US-20170190669-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME ABHD6, FAAH, FAAH2 HPGD 297/4885ALDH1A1 1322/4885PROKR1 2789/4885
US-20180327410-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME FAAH, FAAH2, MGLL HPGD 48/4885ALDH1A1 1378/4885PROKR1 3571/4885
US-10093630-B2 Pyrazole compounds and methods of making and using same ABHD6, FAAH, FAAH2 HPGD 297/4885ALDH1A1 1322/4885PROKR1 2789/4885
US-20100113776-A1 PYRAZOLE DERIVATIVE HRH3, HRH4, HRH1 HPGD 1756/4885ALDH1A1 2729/4885PROKR1 269/4885
US-10385057-B2 Pyrazole compounds and methods of making and using same FAAH, FAAH2, MGLL HPGD 48/4885ALDH1A1 1378/4885PROKR1 3571/4885

“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.