SCHEMBL5532672

SCHEMBL5532672

NC(=S)NCc1ccccc1F

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.55
MEN1 O00255 4/20 0.55
LMNA P02545 4/20 0.54
MAPT P10636 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
PKM P14618 1/20 0.54
CRHBP P24387 1/20 0.54
CRHR2 Q13324 1/20 0.54
RIPK1 Q13546 1/20 0.49
HTT P42858 1/20 0.48
HPGD P15428 2/20 0.47
ALDH1A1 P00352 1/20 0.46
HDAC1 Q13547 1/20 0.46
PPIA P62937 1/20 0.45
TAAR1 Q96RJ0 1/20 0.45
MPO P05164 1/20 0.45

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
SCHEMBL3918747 0.81 TAAR1 (0.55) KMT2AMEN1LMNAMAPTHPGD
SCHEMBL28269593 0.81 ALDH1A1 (0.47) KMT2AMEN1LMNAMAPTSMN1; SMN2
SCHEMBL31344502 0.81 RIPK1 (0.49) KMT2AMEN1LMNAMAPTSMN1; SMN2
SCHEMBL5527359 0.81 ALDH1A1 (0.59) KMT2AMEN1LMNAMAPTSMN1; SMN2
SCHEMBL10310299 0.81 RIPK1 (0.49) KMT2AMEN1LMNAMAPTSMN1; SMN2
SCHEMBL27805137 0.78 TSHR (0.57) KMT2AMEN1MAPTPKMHTT
SCHEMBL8954327 0.77 NPC1 (0.61) KMT2AMEN1LMNAMAPTSMN1; SMN2
SCHEMBL16108114 0.77 KMT2A (0.49) KMT2ALMNAMAPTRIPK1HPGD
SCHEMBL5523322 0.77 ALDH1A1 (0.54) KMT2AMEN1LMNAMAPTSMN1; SMN2
SCHEMBL16108275 0.77 EPHX2 (0.50) HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115636815-B Preparation method and application of pomalidomide connected urea compound 新乡学院 2023-10-27 CN disclosed
US-9353089-B2 Compositions and methods for the treatment of malaria SAINT LOUIS UNIVERSITY (US) 2016-05-31 US disclosed
US-20140296532-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF MALARIA GUANGZHOU INSTITUTES OF BIOMEDICINE AND HEALTH, CHINESE ACADEMY OF SCIENCES (CN) 2014-10-02 US disclosed
US-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof ARENA PHARMACEUTICALS, INC. 2007-01-11 US disclosed
CN-1169730-A Aromatic heterocyclic derivatives as enzyme inhibitors CORVAS INT INC (US) 1998-01-07 CN 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-20070010671-A1 Novel quinazoline derivatives and methods of treatment related to the use thereof MCHR1, GPR119, MCHR2 KMT2A 792/4885MEN1 647/4885LMNA 2932/4885
US-20140296532-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF MALARIA BACE2, DNPEP, ACE KMT2A 960/4885MEN1 2432/4885LMNA 1932/4885

“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.