SCHEMBL1625612

SCHEMBL1625612

Cc1cc(Cl)c([N+](=O)[O-])cc1C#N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 4/20 0.51
MERTK Q12866 2/20 0.44
MAPT P10636 4/20 0.42
ALDH1A1 P00352 2/20 0.42
HTT P42858 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
GRIA1 P42261 2/20 0.41
GRIA2 P42262 2/20 0.41
GRIA3 P42263 2/20 0.41
GRIA4 P48058 2/20 0.41
GRM6 O15303 1/20 0.41
CYP1A2 P05177 1/20 0.41
ALOX15 P16050 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP3A4 P08684 1/20 0.41
PGK1 P00558 1/20 0.41
POLB P06746 1/20 0.41
CYP2C9 P11712 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
SCHEMBL2403679 0.93 VCAM1 (0.51) VCAM1MERTKMAPTALDH1A1HTT
SCHEMBL1344104 0.86 VCAM1 (0.51) VCAM1MERTKMAPTALDH1A1HTT
SCHEMBL7642508 0.85 VCAM1 (0.58) VCAM1MERTKMAPTALDH1A1HTT
SCHEMBL773066 0.85 VCAM1 (0.49) VCAM1MAPTALDH1A1HTTTSHR
SCHEMBL14739198 0.84 VCAM1 (0.47) VCAM1MAPTALDH1A1HTTTSHR
SCHEMBL1624405 0.84 VCAM1 (0.56) VCAM1MERTKMAPTALDH1A1HTT
SCHEMBL9536669 0.80 VCAM1 (0.56) VCAM1MERTKMAPTALDH1A1HTT
SCHEMBL7024321 0.80 VCAM1 (0.47) VCAM1MAPTALDH1A1HTTTSHR
SCHEMBL1343713 0.80 VCAM1 (0.61) VCAM1MERTKMAPTALDH1A1HTT
SCHEMBL1344102 0.79 VCAM1 (0.56) VCAM1MERTKMAPTALDH1A1HTT

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250263399-A1 CBL-B MODULATORS AND USES THEREOF SCHRÖDINGER, INC. 2025-08-21 US disclosed
US-12325697-B2 CBL-B modulators and uses thereof NIMBUS CLIO, INC. (US) 2025-06-10 US disclosed
CN-117858707-A CBL-B modulators and uses thereof 林伯士克莱奥公司 2024-04-09 CN disclosed
EP-4319756-A1 CBL-B MODULATORS AND USES THEREOF Nimbus Clio, Inc. (US) 2024-02-14 EP disclosed
US-20230086064-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS DISCOVERY, INC. 2023-03-23 US disclosed
WO-2022217276-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-10-13 WO disclosed
CN-110312711-A Heterocyclic compound and its application method as RAS inhibitor 亚瑞克西斯制药公司 2019-10-08 CN disclosed
EP-3523289-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF RAS AND METHODS OF USE THEREOF Araxes Pharma LLC (US) 2019-08-14 EP disclosed
US-10377743-B2 Inhibitors of RAS and methods of use thereof ARAXES PHARMA LLC (US) 2019-08-13 US disclosed
US-20180127396-A1 INHIBITORS OF RAS AND METHODS OF USE THEREOF ARAXES PHARMA LLC 2018-05-10 US disclosed
CN-1477960-A EPA receptor inhibitors to treat rheumatoid arthritis 2004-02-25 CN disclosed
CN-1476448-A Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents ������ҩ�����޹�˾ 2004-02-18 CN disclosed
US-20030236260-A1 Use of EP4 receptor ligands in the treatment of IL-6 involved diseases SHIMOJO MASATO 2003-12-25 US disclosed
WO-2003086371-A2 USE OF EP4 RECEPTOR LIGANDS IN THE TREATMENT OF IL-6 INVOLVED DISEASES PFIZER JAPAN INC. (JP) 2003-10-23 WO disclosed
EP-1326864-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2003-07-16 EP disclosed
EP-1326606-A2 EP4 RECEPTOR INHIBITORS TO TREAT RHEUMATOID ARTHRITIS PFIZER PHARMACEUTICALS INC. (JP) 2003-07-16 EP disclosed
US-20020107273-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents ASKAT INC. (JP) 2002-08-08 US disclosed
US-20020077329-A1 EP4 receptor inhibitors to treat rheumatoid arthritis PFIZER PHARMACEUTICALS INC. (JP) 2002-06-20 US disclosed
WO-2002032422-A2 EP4 RECEPTOR INHIBITORS TO TREAT RHEUMATOID ARTHRITIS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 WO disclosed
WO-2002032900-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 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 (8 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-10377743-B2 Inhibitors of RAS and methods of use thereof KRAS, NRAS, HRAS VCAM1 4709/4885MERTK 3889/4885MAPT 4690/4885
US-20230086064-A1 CBL-B MODULATORS AND USES THEREOF CBLB, CBL, CBLC VCAM1 3666/4885MERTK 209/4885MAPT 3660/4885
US-20020107273-A1 Aryl or heteroaryl fused imidazole compounds as anti-inflammatory and analgesic agents PTGS1, PTGS2, OPRM1 VCAM1 2233/4885MERTK 4820/4885MAPT 3250/4885
US-20030236260-A1 Use of EP4 receptor ligands in the treatment of IL-6 involved diseases PTGER4, PTGER1, IL6 VCAM1 516/4885MERTK 1693/4885MAPT 4402/4885
US-20250263399-A1 CBL-B MODULATORS AND USES THEREOF CBLB, CBL, CBLC VCAM1 3666/4885MERTK 209/4885MAPT 3660/4885
US-20180127396-A1 INHIBITORS OF RAS AND METHODS OF USE THEREOF KRAS, NRAS, HRAS VCAM1 4721/4885MERTK 3836/4885MAPT 4679/4885
US-12325697-B2 CBL-B modulators and uses thereof CBLB, CBL, CBLC VCAM1 3666/4885MERTK 209/4885MAPT 3660/4885
US-20020077329-A1 EP4 receptor inhibitors to treat rheumatoid arthritis PTGER4, PTGER1, PTGER2 VCAM1 809/4885MERTK 2132/4885MAPT 4854/4885

“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.