SCHEMBL319323

SCHEMBL319323

CC1(F)C(=O)N(CCCCl)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KMT2A Q03164 3/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
ALDH1A1 P00352 3/20 0.40
SCN9A Q15858 2/20 0.40
CRHR1 P34998 2/20 0.40
CRHR2 Q13324 1/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39

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
SCHEMBL16264926 0.87 ALDH1A1 (0.52) LMNASMN1; SMN2KMT2AALDH1A1SCN9A
SCHEMBL319784 0.85 KMT2A (0.51) LMNASMN1; SMN2KMT2ACYP1A2CYP2D6
SCHEMBL318245 0.85 LMNA (0.49) LMNASMN1; SMN2KMT2ACYP1A2CYP2D6
SCHEMBL10251912 0.83 LMNA (0.45) LMNASMN1; SMN2KMT2ACYP1A2CYP2D6
SCHEMBL318944 0.78 LMNA (0.51) LMNASMN1; SMN2ALDH1A1
SCHEMBL11640502 0.75 LMNA (0.49) LMNASMN1; SMN2
SCHEMBL7836181 0.75 LMNA (0.44) LMNASMN1; SMN2KMT2AALDH1A1SCN9A
SCHEMBL31294858 0.74 MAPT (0.53) LMNASMN1; SMN2KMT2AALDH1A1MAPT
SCHEMBL507636 0.73 KMT2A (0.51) LMNASMN1; SMN2KMT2ACYP1A2CYP2D6
SCHEMBL18601760 0.73 KMT2A (0.51) LMNASMN1; SMN2KMT2ACYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3138841-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC (US) 2017-03-08 EP disclosed
US-9156840-B2 D2 antagonists, methods of synthesis and methods of use Altos Therapeutics, LLC (US) 2015-10-13 US disclosed
US-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-11-27 US disclosed
EP-2582701-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC (US) 2013-04-24 EP disclosed
US-20120010228-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC 2012-01-12 US disclosed
WO-2011160084-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC (US) 2011-12-22 WO 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-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE DRD2, DRD3, AVPR2 LMNA 4596/4885SMN1; SMN2 3145/4885KMT2A 2446/4885
US-20120010228-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE DRD2, DRD3, AVPR2 LMNA 4596/4885SMN1; SMN2 3145/4885KMT2A 2446/4885

“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.